Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2684964624
Compound
Show structures
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 | 5 USD | 97 | 14 working days | Get Quote |
| 5 mg | 5 USD | 97 | 14 working days | Get Quote |
| 10 mg | 5 USD | 97 | 14 working days | Get Quote |
- 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-2684964624.sdf |
| SMILES | MCULE-2684964624.smiles |
| Standard InChI | MCULE-2684964624.inchi |
| InChIKey | MCULE-2684964624.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867548202 | 98 | As is | in stock |
| P-875705368 | 98 | As is | in stock |
| P-1275201984 | 98 | As is | in stock |
| P-903030200 | 97 | As is | 500 g |
| P-905479369 | 95 | As is | 100 g |
| P-610960505 | 90 | As is | 25.6424 kg |
| P-901164723 | 98 | As is | in stock |
| P-1270288672 | 98 | As is | in stock |
| P-580242844 | 95 | As is | by synthesis |
| P-617053402 | 95 | As is | by resynthesis (? - ? days) |
| P-606836596 | N/A | As is | in stock |
| P-489166119 | 97 | As is | in stock |
| P-596926652 | 98 | As is | 645.66 g |
| P-895957759 | 95 | As is | 24 g |
| P-864096635 | 95 | As is | in stock |
| P-580734434 | 98 | As is | 567.5 g |
| P-901459631 | 95 | As is | by synthesis |
| P-579721883 | N/A | As is | unavailable |
| P-851238848 | 95 | As is | by synthesis |
| P-861275024 | 95 | As is | in stock |
| P-868581101 | 95 | As is | in stock |
| P-580405739 | 95 | As is | by resynthesis (? - ? days) |
| P-889434179 | 98 | As is | 20.1322 kg |
| P-889114216 | 95 | As is | 79.8 g |
| P-905359056 | 98 | As is | 315 g |
| P-505544686 | 95 | As is | in stock |
| P-524169801 | 95 | As is | 1.007 g |
| P-855993679 | 95 | As is | 1.007 g |
| P-579623977 | 95 | As is | in stock |
| P-500223948 | 96 | As is | in stock |
| P-580489800 | N/A | As is | by synthesis |
| P-1272578566 | 97 | As is | 3 kg |
| P-852439892 | 97 | As is | by synthesis |
| P-854726158 | 95 | As is | in stock |
| P-888904037 | N/A | As is | in stock |
| P-885544575 | 95 | As is | by synthesis |
| P-613807731 | 95 | As is | in stock |
| P-893298368 | 95 | As is | in stock |
| P-498648857 | 97 | As is | 12.195 kg |
| P-906900907 | 97 | As is | in stock |
| P-611389567 | 90 | As is | in stock |
| P-611493564 | 90 | As is | in stock |
| P-615645829 | 95 | As is | unavailable |
| P-480964469 | 97 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 261.024 |
| logP | 1.1209 |
| H-bond acceptors | 5 |
| H-bond donors | 2 |
| Rotatable bonds | 0 |
| PSA | 80.48 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 48.8051 |
| Atoms | 15 |
| Rings | 2 |
| Heavy atoms | 11 |
| Hydrogen atoms | 4 |
| Heteroatoms | 6 |
| N/O atoms | 5 |
| 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 |
