Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3058677738
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 | 7 USD | 95 | 14 working days | Get Quote |
| 5 mg | 7 USD | 95 | 14 working days | Get Quote |
| 10 mg | 7 USD | 95 | 14 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-3058677738.sdf |
| SMILES | MCULE-3058677738.smiles |
| Standard InChI | MCULE-3058677738.inchi |
| InChIKey | MCULE-3058677738.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-860616128 | 95 | As is | by synthesis |
| P-901277192 | N/A | As is | in stock |
| P-615712786 | 95 | As is | in stock |
| P-903179591 | 98 | As is | 15 g |
| P-893580487 | 90 | As is | 870 mg |
| P-901167349 | 98 | As is | in stock |
| P-851427185 | N/A | As is | by synthesis |
| P-865924148 | 98 | As is | 200 mg |
| P-869390866 | 95 | As is | in stock |
| P-590760913 | 95 | As is | by synthesis |
| P-577180379 | 90 | As is | by synthesis |
| P-454760415 | 90 | As is | in stock |
| P-619306911 | 90 | As is | 2 mg |
| P-436470000 | 95 | As is | 5 g |
| P-901649549 | 95 | As is | in stock |
| P-34572758 | 90 | As is | in stock |
| P-580779798 | 90 | As is | by resynthesis (? - ? days) |
| P-580768908 | 90 | As is | in stock |
| P-861946959 | 95 | As is | 1.52 g |
| P-488547905 | 90 | As is | in stock |
| P-13599770 | 95 | As is | 300 mg |
| P-596595241 | 90 | As is | 1000 mg |
| P-580463644 | 95 | As is | by synthesis |
| P-852448993 | N/A | As is | in stock |
| P-855400846 | 95 | As is | in stock |
| P-454371092 | 92 | As is | in stock |
| P-13760154 | 92 | As is | 300 mg |
| P-491132728 | 95 | As is | by synthesis |
| P-23882402 | 90 | As is | in stock |
| P-33467895 | 90 | As is | in stock |
| P-502345266 | 90 | As is | in stock |
| P-906816992 | 98 | As is | by synthesis |
| P-855236856 | 90 | As is | in stock |
| P-1234303 | 90 | As is | 160 mg |
| P-886900464 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 299.281 |
| logP | 2.1117 |
| H-bond acceptors | 7 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 85.95 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 78.3663 |
| Atoms | 35 |
| Rings | 3 |
| Heavy atoms | 22 |
| Hydrogen atoms | 13 |
| Heteroatoms | 7 |
| N/O atoms | 7 |
| 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 |
