Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1783272167
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 | 20 USD | 97 | 20 working days | Get Quote |
| 5 mg | 43 USD | 98 | 16 working days | Get Quote |
| 10 mg | 63 USD | 98 | 16 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-1783272167.sdf |
| SMILES | MCULE-1783272167.smiles |
| Standard InChI | MCULE-1783272167.inchi |
| InChIKey | MCULE-1783272167.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867616553 | 98 | As is | in stock |
| P-875777789 | N/A | As is | in stock |
| P-590399332 | 98 | As is | in stock |
| P-903120415 | 97 | As is | 200 mg |
| P-1264047355 | 95 | As is | in stock |
| P-610959658 | 90 | As is | 8.346 g |
| P-606848766 | N/A | As is | in stock |
| P-489168738 | 97 | As is | in stock |
| P-596963805 | 97 | As is | 1.014 g |
| P-872723823 | 98 | As is | in stock |
| P-864140087 | 97 | As is | in stock |
| P-860056729 | 98 | As is | by synthesis |
| P-868544315 | 98 | As is | in stock |
| P-580725100 | 98 | As is | 1.176 g |
| P-901464181 | 95 | As is | by synthesis |
| P-881634127 | 98 | As is | in stock |
| P-851247405 | 95 | As is | by synthesis |
| P-860799560 | 98 | As is | in stock |
| P-579478552 | 95 | As is | in stock |
| P-675215317 | 95 | As is | in stock |
| P-596561835 | 97 | As is | 50 mg |
| P-852522479 | N/A | As is | in stock |
| P-854720238 | 95 | As is | in stock |
| P-474027486 | 95 | As is | in stock |
| P-608270587 | 98 | As is | in stock |
| P-885538281 | 95 | As is | by synthesis |
| P-579711283 | N/A | As is | in stock |
| P-869161828 | 95 | As is | by synthesis |
| P-892296642 | 95 | As is | unavailable |
| P-888657213 | 95 | As is | 181 mg |
| P-611441330 | 90 | As is | in stock |
| P-480840810 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 607.623 |
| logP | 6.8344 |
| H-bond acceptors | 7 |
| H-bond donors | 0 |
| Rotatable bonds | 6 |
| PSA | 71.33 |
| RO5 violations | 2 |
| RO3 violations | 5 |
| Refractivity | 176.659 |
| Atoms | 73 |
| Rings | 7 |
| Heavy atoms | 45 |
| Hydrogen atoms | 28 |
| Heteroatoms | 10 |
| N/O atoms | 7 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| 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 |
