Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6159667172
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 | 30 USD | 95 | 7 working days | Get Quote |
| 5 mg | 39 USD | 95 | 22 working days | Get Quote |
| 10 mg | 73 USD | 95 | 22 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-6159667172.sdf |
| SMILES | MCULE-6159667172.smiles |
| Standard InChI | MCULE-6159667172.inchi |
| InChIKey | MCULE-6159667172.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867611878 | 95 | As is | in stock |
| P-875772069 | N/A | As is | in stock |
| P-505394249 | 98 | As is | in stock |
| P-869282308 | 98 | As is | in stock |
| P-903111856 | 96 | As is | 750 mg |
| P-893494290 | 90 | As is | 1.503 g |
| P-893291545 | N/A | As is | in stock |
| P-489244321 | 97 | As is | in stock |
| P-865914684 | 96 | As is | 750 mg |
| P-872726055 | 98 | As is | in stock |
| P-889777790 | 95 | As is | in stock |
| P-872868292 | 99 | As is | in stock |
| P-893280010 | 99 | As is | 1.138 g |
| P-871218989 | N/A | As is | by resynthesis (? - ? days) |
| P-871216192 | 95 | As is | by synthesis |
| P-861286479 | 98 | As is | in stock |
| P-580450692 | 98 | As is | in stock |
| P-861521264 | 95 | As is | by synthesis |
| P-900266213 | 95 | As is | in stock |
| P-524166500 | 95 | As is | 100 mg |
| P-904641441 | 95 | As is | by synthesis |
| P-854716841 | 95 | As is | in stock |
| P-871066990 | 95 | As is | in stock |
| P-878643784 | 98 | As is | in stock |
| P-869118648 | 95 | As is | by synthesis |
| P-892288873 | 95 | As is | unavailable |
| P-888633691 | 95 | As is | 202 mg |
| P-906791193 | 96 | As is | by synthesis |
| P-855065893 | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 285.687 |
| logP | 3.3543 |
| H-bond acceptors | 6 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 82.24 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 75.4044 |
| Atoms | 28 |
| Rings | 4 |
| Heavy atoms | 20 |
| Hydrogen atoms | 8 |
| Heteroatoms | 7 |
| N/O atoms | 6 |
| 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 |
