Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6182027972
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 | 19 USD | 92 | 18 working days | Get Quote |
| 5 mg | 23 USD | 95 | 20 working days | Get Quote |
| 10 mg | 23 USD | 95 | 20 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-6182027972.sdf |
| SMILES | MCULE-6182027972.smiles |
| Standard InChI | MCULE-6182027972.inchi |
| InChIKey | MCULE-6182027972.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867637201 | 95 | As is | in stock |
| P-875801996 | N/A | As is | in stock |
| P-595217615 | 95 | As is | in stock |
| P-903157605 | 97 | As is | 11 g |
| P-610971650 | 90 | As is | 171.829 g |
| P-907307216 | 95 | As is | 136 g |
| P-893300568 | N/A | As is | in stock |
| P-606853303 | N/A | As is | in stock |
| P-865921448 | 95 | As is | 20 g |
| P-895938834 | 95 | As is | by resynthesis (? - ? days) |
| P-864125877 | 95 | As is | in stock |
| P-619602581 | 95 | As is | 9.357 g |
| P-454735054 | 90 | As is | in stock |
| P-436474058 | 95 | As is | in stock |
| P-34859129 | 90 | As is | in stock |
| P-861496292 | 97 | As is | by synthesis |
| P-862021968 | 95 | As is | 74.75 g |
| P-488552191 | 90 | As is | in stock |
| P-13565446 | 95 | As is | 265 mg |
| P-563497525 | 95 | As is | 1000 mg |
| P-852533910 | N/A | As is | in stock |
| P-895183747 | 95 | As is | in stock |
| P-454369780 | 92 | As is | in stock |
| P-13968795 | 92 | As is | 300 mg |
| P-885520074 | 95 | As is | by synthesis |
| P-519872990 | 90 | As is | in stock |
| P-892274036 | 95 | As is | by synthesis |
| P-892299102 | 95 | As is | unavailable |
| P-892350536 | 95 | As is | 1.035 g |
| P-502374261 | 90 | As is | in stock |
| P-888453625 | 94 | As is | by resynthesis (? - ? days) |
| P-906878476 | 95 | As is | by synthesis |
| P-611606702 | 90 | As is | in stock |
| P-1868672 | 90 | As is | 64 mg |
| P-893992535 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 221.684 |
| logP | 3.0321 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 3 |
| PSA | 50.94 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 63.5731 |
| Atoms | 27 |
| Rings | 2 |
| Heavy atoms | 15 |
| Hydrogen atoms | 12 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
