Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
UNKNOWN STEREO
MCULE-2310704727
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 | 7 working days | Get Quote |
| 5 mg | 57 USD | 95 | 7 working days | Get Quote |
| 10 mg | 90 USD | 95 | 7 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-2310704727.sdf |
| SMILES | MCULE-2310704727.smiles |
| Standard InChI | MCULE-2310704727.inchi |
| InChIKey | MCULE-2310704727.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867566543 | 98 | As is | in stock |
| P-875726382 | N/A | As is | in stock |
| P-890254586 | 97 | As is | by synthesis |
| P-613852742 | 95 | As is | in stock |
| P-580269416 | 95 | As is | by synthesis |
| P-596987518 | 97 | As is | 500 mg |
| P-864122008 | 97 | As is | in stock |
| P-893236801 | 95 | As is | in stock |
| P-860798787 | 98 | As is | in stock |
| P-580451472 | 99 | As is | in stock |
| P-505530755 | 95 | As is | in stock |
| P-590488963 | 90 | As is | 10 mg |
| P-869116723 | 95 | As is | by synthesis |
| P-892288390 | 95 | As is | unavailable |
| P-888632194 | 95 | As is | 50 mg |
| P-611483677 | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 275.342 |
| logP | 2.9489 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 47.56 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 80.7297 |
| Atoms | 41 |
| Rings | 3 |
| Heavy atoms | 20 |
| Hydrogen atoms | 21 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| 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 |
