Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6392551981
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 | 11 USD | N/A | 9 working days | Get Quote |
| 5 mg | 11 USD | N/A | 9 working days | Get Quote |
| 10 mg | 11 USD | N/A | 9 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.
-
MCULE-5875758549
- Component type: Main
-
MCULE-6664742315
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-6392551981.sdf |
| SMILES | MCULE-6392551981.smiles |
| Standard InChI | MCULE-6392551981.inchi |
| InChIKey | MCULE-6392551981.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867626233 | 98 | As is | in stock |
| P-875789411 | N/A | As is | in stock |
| P-595216411 | 98 | As is | in stock |
| P-903140535 | 98 | As is | 25 g |
| P-610953774 | 90 | As is | 560 g |
| P-606862490 | N/A | As is | in stock |
| P-489157161 | 97 | As is | in stock |
| P-865918932 | 98 | As is | 100 g |
| P-494391802 | 95 | As is | by resynthesis (? - ? days) |
| P-864100169 | 95 | As is | in stock |
| P-851265819 | 95 | As is | by synthesis |
| P-861276196 | 95 | As is | in stock |
| P-868605822 | 97 | As is | in stock |
| P-580290272 | N/A | As is | by resynthesis (? - ? days) |
| P-905318564 | 95 | As is | in stock |
| P-18820189 | 90 | As is | 2.449 g |
| P-454400098 | 90 | As is | 2.449 g |
| P-580491128 | N/A | As is | by synthesis |
| P-852481506 | N/A | As is | in stock |
| P-854782955 | 95 | As is | by synthesis |
| P-888858028 | N/A | As is | in stock |
| P-613810265 | 95 | As is | in stock |
| P-498679132 | 97 | As is | 262 g |
| P-906878059 | 98 | As is | by synthesis |
| P-855222730 | 90 | As is | in stock |
| P-575299645 | 95 | As is | in stock |
| P-612931370 | 97 | As a main component | by synthesis |
| P-890140813 | N/A | As a main component | in stock |
| P-894675946 | 95 | As a main component | in stock |
| P-903031797 | 95 | As a main component | 20 g |
| P-891646583 | N/A | As a main component | by synthesis |
| P-851772478 | N/A | As a main component | by synthesis |
| P-489220978 | 97 | As a main component | in stock |
| P-901337280 | 95 | As a main component | by synthesis |
| P-901861935 | 95 | As a main component | by synthesis |
| P-666952057 | 95 | As a main component | by synthesis |
| P-851298184 | 95 | As a main component | by synthesis |
| P-861465112 | 95 | As a main component | by synthesis |
| P-563597386 | 95 | As a main component | 5 g |
| P-580509682 | N/A | As a main component | by synthesis |
| P-854782954 | 95 | As a main component | by synthesis |
| P-613805762 | 95 | As a main component | in stock |
| P-498684588 | 97 | As a main component | 0 mg |
| P-886922772 | 95 | As a main component | by synthesis |
| P-666974920 | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 252.353 |
| logP | 3.3047 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 29.26 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 82.5274 |
| Atoms | 39 |
| Rings | 3 |
| Heavy atoms | 19 |
| Hydrogen atoms | 20 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| 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 |
