Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2702439257
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 | 17 USD | 95 | 22 working days | Get Quote |
| 5 mg | 27 USD | 95 | 7 working days | Get Quote |
| 10 mg | 44 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-2702439257.sdf |
| SMILES | MCULE-2702439257.smiles |
| Standard InChI | MCULE-2702439257.inchi |
| InChIKey | MCULE-2702439257.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867622362 | 95 | As is | in stock |
| P-875785083 | N/A | As is | in stock |
| P-869320489 | 95 | As is | in stock |
| P-505394490 | 95 | As is | in stock |
| P-903133192 | 95 | As is | 150 mg |
| P-1264055245 | 95 | As is | in stock |
| P-893605746 | 90 | As is | 1.747 g |
| P-851938873 | N/A | As is | in stock |
| P-619157615 | 95 | As is | 150 mg |
| P-580193928 | 98 | As is | in stock |
| P-864136749 | 95 | As is | in stock |
| P-611004133 | 95 | As is | 155 mg |
| P-861511123 | 95 | As is | by synthesis |
| P-524166657 | 95 | As is | 100 mg |
| P-854718107 | 95 | As is | in stock |
| P-584616531 | 95 | As is | in stock |
| P-878644470 | 98 | As is | in stock |
| P-889880231 | 95 | As is | by synthesis |
| P-869118536 | 95 | As is | by synthesis |
| P-892288825 | 95 | As is | unavailable |
| P-888633596 | 95 | As is | 152 mg |
| P-906799429 | 95 | As is | by synthesis |
| P-855235495 | 90 | As is | in stock |
| P-615457828 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 293.247 |
| logP | 3.2561 |
| H-bond acceptors | 4 |
| H-bond donors | 0 |
| Rotatable bonds | 1 |
| PSA | 60.17 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 75.204 |
| Atoms | 30 |
| Rings | 4 |
| Heavy atoms | 22 |
| Hydrogen atoms | 8 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
