Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5851588651
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 | 36 USD | 95 | 26 working days | Get Quote |
| 5 mg | 36 USD | 95 | 26 working days | Get Quote |
| 10 mg | 37 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-5851588651.sdf |
| SMILES | MCULE-5851588651.smiles |
| Standard InChI | MCULE-5851588651.inchi |
| InChIKey | MCULE-5851588651.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867551331 | 95 | As is | in stock |
| P-875709247 | N/A | As is | in stock |
| P-615718664 | 95 | As is | in stock |
| P-903035247 | 95 | As is | 15 g |
| P-893616480 | 90 | As is | 60.15 g |
| P-878260353 | N/A | As is | in stock |
| P-881089281 | 95 | As is | 20 g |
| P-889786673 | 95 | As is | in stock |
| P-878234138 | 95 | As is | 8.093 g |
| P-492246898 | 95 | As is | in stock |
| P-5195767 | 90 | As is | 10 mg |
| P-619932933 | 90 | As is | by synthesis |
| P-436446061 | 95 | As is | 10 g |
| P-20013166 | 90 | As is | in stock |
| P-868633430 | 95 | As is | in stock |
| P-34801989 | 90 | As is | in stock |
| P-861930583 | 95 | As is | 25.15 g |
| P-905329894 | 95 | As is | 1000 mg |
| P-596590646 | 90 | As is | 5 g |
| P-852396738 | N/A | As is | in stock |
| P-895225694 | 95 | As is | in stock |
| P-500396276 | 95 | As is | by synthesis |
| P-885525675 | 95 | As is | by synthesis |
| P-23904002 | 90 | As is | in stock |
| P-22923018 | 90 | As is | in stock |
| P-888563047 | 94 | As is | by resynthesis (? - ? days) |
| P-611435904 | 90 | As is | in stock |
| P-1328392 | 90 | As is | 650 mg |
| P-3235441 | 90 | As is | 650 mg |
| P-872760754 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 263.290 |
| logP | 3.9084 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 50.19 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 79.1043 |
| Atoms | 33 |
| Rings | 3 |
| Heavy atoms | 20 |
| Hydrogen atoms | 13 |
| 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 |
