Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8693579543
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 | 8 USD | 98 | 22 working days | Get Quote |
| 5 mg | 13 USD | 98 | 11 working days | Get Quote |
| 10 mg | 13 USD | 98 | 11 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-8693579543.sdf |
| SMILES | MCULE-8693579543.smiles |
| Standard InChI | MCULE-8693579543.inchi |
| InChIKey | MCULE-8693579543.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867661264 | 98 | As is | in stock |
| P-875830108 | N/A | As is | in stock |
| P-869190114 | 95 | As is | in stock |
| P-505391069 | 98 | As is | in stock |
| P-903205227 | 98 | As is | 10 g |
| P-893524232 | 90 | As is | 18.124 g |
| P-606866578 | N/A | As is | in stock |
| P-489161408 | 97 | As is | in stock |
| P-25941584 | 70 | As is | 57 mg |
| P-596972587 | 98 | As is | 5 g |
| P-872728654 | 98 | As is | in stock |
| P-864147847 | 99 | As is | in stock |
| P-900154616 | 95 | As is | in stock |
| P-580701478 | 98 | As is | 2.85 g |
| P-900267988 | N/A | As is | by resynthesis (? - ? days) |
| P-893230743 | 95 | As is | in stock |
| P-452653736 | 98 | As is | in stock |
| P-886856777 | 95 | As is | by synthesis |
| P-868576716 | 98 | As is | in stock |
| P-579477337 | 95 | As is | in stock |
| P-870652517 | 96 | As is | in stock |
| P-505523929 | 95 | As is | in stock |
| P-524165112 | 98 | As is | 250 mg |
| P-579612900 | 98 | As is | unavailable |
| P-895202491 | 95 | As is | by synthesis |
| P-854692073 | 95 | As is | in stock |
| P-584619121 | 95 | As is | in stock |
| P-878641620 | 98 | As is | in stock |
| P-888890305 | N/A | As is | in stock |
| P-500387842 | 98 | As is | by synthesis |
| P-885546615 | 95 | As is | by synthesis |
| P-617402994 | N/A | As is | in stock |
| P-892246464 | 95 | As is | by synthesis |
| P-869176680 | 95 | As is | in stock |
| P-892293824 | 95 | As is | 532 mg |
| P-892333196 | 95 | As is | 532 mg |
| P-873222417 | 90 | As is | in stock |
| P-33162486 | 90 | As is | 170 mg |
| P-611395065 | 90 | As is | in stock |
| P-611378626 | 90 | As is | in stock |
| P-575300885 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 270.236 |
| logP | 2.5768 |
| H-bond acceptors | 5 |
| H-bond donors | 3 |
| Rotatable bonds | 1 |
| PSA | 90.9 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 73.989 |
| Atoms | 30 |
| Rings | 3 |
| Heavy atoms | 20 |
| Hydrogen atoms | 10 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| 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 |
