Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2654184294-0
Structure
Show compound
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 | 31 USD | 97 | 20 working days | Get Quote |
| 5 mg | 31 USD | 97 | 20 working days | Get Quote |
| 10 mg | 31 USD | 97 | 20 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-2654184294-0.sdf |
| SMILES | MCULE-2654184294-0.smiles |
| Standard InChI | MCULE-2654184294-0.inchi |
| InChIKey | MCULE-2654184294-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-872837069 | 97 | As is | in stock |
| P-890181083 | 97 | As is | in stock |
| P-615715541 | 95 | As is | by resynthesis (? - ? days) |
| P-903293585 | 97 | As is | 50 g |
| P-905492457 | 95 | As is | 10 g |
| P-893553912 | 90 | As is | 414 g |
| P-1270377548 | 97 | As is | in stock |
| P-867708079 | N/A | As is | in stock |
| P-881115752 | 97 | As is | 10 g |
| P-1273414619 | 95 | As is | by resynthesis (? - ? days) |
| P-869386703 | 95 | As is | in stock |
| P-861315822 | 97 | As is | 31.975 g |
| P-517290273 | 95 | As is | in stock |
| P-517093807 | 90 | As is | in stock |
| P-861346320 | 95 | As is | by synthesis |
| P-889382929 | 97 | As is | 50 g |
| P-619802940 | 96 | As is | in stock |
| P-855980951 | 97 | As is | 1000 mg |
| P-1272600894 | N/A | As is | 1000 mg |
| P-852572252 | N/A | As is | by synthesis |
| P-854928636 | 95 | As is | by synthesis |
| P-491190660 | 95 | As is | by synthesis |
| P-873228235 | 90 | As is | in stock |
| P-888592417 | 94 | As is | by resynthesis (? - ? days) |
| P-906753637 | 99 | As is | by synthesis |
| P-906902564 | 95 | As is | in stock |
| P-906840850 | 97 | As is | by synthesis |
| P-906762515 | 97 | As is | by synthesis |
| P-906799653 | 97 | As is | by synthesis |
| P-906830891 | 97 | As is | by synthesis |
| P-906798641 | 97 | As is | by synthesis |
| P-906809396 | 98 | As is | by synthesis |
| P-906813492 | 97 | As is | by synthesis |
| P-906756150 | 98 | As is | by synthesis |
| P-906767170 | 98 | As is | by synthesis |
| P-906765896 | 98 | As is | by synthesis |
| P-906786889 | 98 | As is | by synthesis |
| P-906851658 | 97 | As is | by synthesis |
| P-906806863 | 98 | As is | by synthesis |
| P-906869844 | 95 | As is | by synthesis |
| P-906789718 | 97 | As is | by synthesis |
| P-906811742 | 97 | As is | by synthesis |
| P-906811743 | 98 | As is | by synthesis |
| P-906825839 | 95 | As is | by synthesis |
| P-906753903 | 97 | As is | by synthesis |
| P-906869873 | 97 | As is | by synthesis |
| P-906855541 | 97 | As is | by synthesis |
| P-906767995 | 97 | As is | by synthesis |
| P-906870395 | 95 | As is | by synthesis |
| P-906811534 | 97 | As is | by synthesis |
| P-906754446 | 97 | As is | by synthesis |
| P-906757294 | 98 | As is | by synthesis |
| P-906829744 | 97 | As is | by synthesis |
| P-906798517 | 95 | As is | by synthesis |
| P-906833600 | 97 | As is | by synthesis |
| P-906870505 | 98 | As is | by synthesis |
| P-906834666 | 95 | As is | by synthesis |
| P-906844138 | 98 | As is | by synthesis |
| P-906754544 | 98 | As is | by synthesis |
| P-906754546 | 95 | As is | by synthesis |
| P-906776052 | 98 | As is | by synthesis |
| P-906842111 | 98 | As is | by synthesis |
| P-1271695007 | 97 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 131.173 |
| logP | 0.7247 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 5 |
| PSA | 63.32 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 35.0252 |
| Atoms | 22 |
| Rings | 0 |
| Heavy atoms | 9 |
| 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 |
