Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3018733071
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 | 47 USD | 95 | 15 working days | Get Quote |
| 5 mg | 47 USD | 95 | 15 working days | Get Quote |
| 10 mg | 47 USD | 95 | 15 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-3018733071.sdf |
| SMILES | MCULE-3018733071.smiles |
| Standard InChI | MCULE-3018733071.inchi |
| InChIKey | MCULE-3018733071.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-892884763 | 95 | As is | in stock |
| P-901301390 | 95 | As is | in stock |
| P-869243439 | 95 | As is | by resynthesis (? - ? days) |
| P-903344344 | 95 | As is | 50 g |
| P-610982595 | 90 | As is | 167.598 g |
| P-1270401676 | 95 | As is | in stock |
| P-1264208889 | N/A | As is | in stock |
| P-892193268 | 95 | As is | 4 g |
| P-1273447483 | 95 | As is | by resynthesis (? - ? days) |
| P-1263785795 | 95 | As is | in stock |
| P-1264198400 | 95 | As is | 12.67 g |
| P-901485707 | 95 | As is | by synthesis |
| P-579722428 | 95 | As is | 160.457 g |
| P-889727728 | 95 | As is | by synthesis |
| P-889291723 | 95 | As is | 107 mg |
| P-855965829 | 95 | As is | 100 mg |
| P-1272592826 | 95 | As is | 5 g |
| P-852490236 | 95 | As is | by synthesis |
| P-895222351 | 95 | As is | in stock |
| P-906883075 | 98 | As is | by synthesis |
| P-855321692 | 90 | As is | in stock |
| P-575325864 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 184.232 |
| logP | 1.5087 |
| H-bond acceptors | 3 |
| H-bond donors | 0 |
| Rotatable bonds | 0 |
| PSA | 35.53 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 48.104 |
| Atoms | 29 |
| Rings | 2 |
| Heavy atoms | 13 |
| Hydrogen atoms | 16 |
| Heteroatoms | 3 |
| 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 |
