Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1317806037
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 | 6 USD | 95 | 14 working days | Get Quote |
| 5 mg | 6 USD | 95 | 14 working days | Get Quote |
| 10 mg | 6 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-1317806037.sdf |
| SMILES | MCULE-1317806037.smiles |
| Standard InChI | MCULE-1317806037.inchi |
| InChIKey | MCULE-1317806037.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867559857 | 98 | As is | in stock |
| P-875719911 | N/A | As is | in stock |
| P-535626484 | 95 | As is | in stock |
| P-505388456 | 98 | As is | in stock |
| P-903049600 | 98 | As is | 9 kg |
| P-907313435 | 95 | As is | by synthesis |
| P-893301828 | N/A | As is | in stock |
| P-606891199 | N/A | As is | in stock |
| P-489115627 | 97 | As is | in stock |
| P-596944934 | 98 | As is | 10 kg |
| P-494323153 | 95 | As is | 17.9 g |
| P-864089929 | 98 | As is | in stock |
| P-901454907 | 95 | As is | by synthesis |
| P-505572512 | 98 | As is | in stock |
| P-504703136 | 85 | As is | 5 mg |
| P-619926978 | 90 | As is | by synthesis |
| P-584579863 | 90 | As is | 20 mg |
| P-287664 | 90 | As is | 255 mg |
| P-436460900 | 95 | As is | 200 g |
| P-855883518 | 95 | As is | 403.31 g |
| P-868576821 | 98 | As is | in stock |
| P-34714280 | 90 | As is | by synthesis |
| P-580290769 | N/A | As is | by resynthesis (? - ? days) |
| P-905329213 | 98 | As is | 676 g |
| P-861926815 | 98 | As is | 5.29958 kg |
| P-870655941 | 98 | As is | in stock |
| P-505519360 | 95 | As is | in stock |
| P-502449141 | 95 | As is | by synthesis |
| P-488554131 | 90 | As is | in stock |
| P-855998500 | 97 | As is | 100 mg |
| P-454396688 | 97 | As is | 500 g |
| P-608080025 | 97 | As is | 1000 g |
| P-500222319 | 98 | As is | in stock |
| P-613281716 | 95 | As is | by synthesis |
| P-580515703 | 98 | As is | 434 g |
| P-852384593 | N/A | As is | in stock |
| P-854729431 | 95 | As is | in stock |
| P-901176908 | 90 | As is | 50 mg |
| P-888860004 | N/A | As is | in stock |
| P-454374675 | 92 | As is | in stock |
| P-500380268 | 98 | As is | by synthesis |
| P-500403694 | 98 | As is | by synthesis |
| P-885528993 | 95 | As is | by synthesis |
| P-24056864 | 90 | As is | in stock |
| P-498640545 | 95 | As is | by synthesis |
| P-896077628 | N/A | As is | 13 mg |
| P-613817052 | 95 | As is | in stock |
| P-498685274 | 98 | As is | 25.6759 kg |
| P-502362556 | 90 | As is | in stock |
| P-903748422 | 94 | As is | by resynthesis (? - ? days) |
| P-906902116 | 97 | As is | in stock |
| P-906801045 | 95 | As is | by synthesis |
| P-611363341 | 90 | As is | in stock |
| P-611466225 | 90 | As is | in stock |
| P-464682326 | 90 | As is | 110 mg |
| P-2372210 | 90 | As is | 110 mg |
| P-893901842 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 166.965 |
| logP | 1.9225 |
| H-bond acceptors | 2 |
| H-bond donors | 0 |
| Rotatable bonds | 0 |
| PSA | 25.78 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 32.01 |
| Atoms | 10 |
| Rings | 1 |
| Heavy atoms | 9 |
| Hydrogen atoms | 1 |
| Heteroatoms | 5 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| 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 |
