Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6749044899
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 | 5 USD | 98 | 14 working days | Get Quote |
| 5 mg | 5 USD | 98 | 14 working days | Get Quote |
| 10 mg | 5 USD | 98 | 14 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.
-
1
MCULE-7622017709
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-6749044899.sdf |
| SMILES | MCULE-6749044899.smiles |
| Standard InChI | MCULE-6749044899.inchi |
| InChIKey | MCULE-6749044899.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-895341296 | 95 | As is | by synthesis |
| P-33219954 | 90 | As is | in stock |
| P-611438818 | 90 | As is | in stock |
| P-867577239 | 98 | Main component | in stock |
| P-875737212 | N/A | Main component | in stock |
| P-597016210 | 98 | Main component | in stock |
| P-869194406 | 97 | Main component | in stock |
| P-505390500 | 99 | Main component | in stock |
| P-903067256 | 98 | Main component | 4 kg |
| P-905481549 | 98 | Main component | 10 g |
| P-580240024 | 95 | Main component | by synthesis |
| P-606925818 | N/A | Main component | in stock |
| P-489189342 | 97 | Main component | in stock |
| P-596951591 | 98 | Main component | 1000 g |
| P-552040001 | 95 | Main component | by resynthesis (? - ? days) |
| P-870025186 | 90 | Main component | 36 mg |
| P-864184758 | 95 | Main component | in stock |
| P-481174873 | 95 | Main component | 50 g |
| P-580708231 | 98 | Main component | 3.55 kg |
| P-454625940 | 90 | Main component | in stock |
| P-584576292 | 90 | Main component | 1.965 g |
| P-888208622 | 95 | Main component | in stock |
| P-612675915 | 90 | Main component | in stock |
| P-868650278 | 98 | Main component | in stock |
| P-34459622 | 90 | Main component | in stock |
| P-580429392 | 95 | Main component | by resynthesis (? - ? days) |
| P-881675128 | N/A | Main component | by resynthesis (? - ? days) |
| P-905359118 | 98 | Main component | 1.5 kg |
| P-502496874 | 95 | Main component | by synthesis |
| P-503008456 | 90 | Main component | by synthesis |
| P-502716356 | 90 | Main component | in stock |
| P-492225269 | 95 | Main component | in stock |
| P-488550734 | 90 | Main component | in stock |
| P-617981628 | 90 | Main component | 300 mg |
| P-454401237 | 97 | Main component | 1000 g |
| P-454318333 | 97 | Main component | 100 mg |
| P-856043301 | 90 | Main component | unavailable |
| P-31212755 | 90 | Main component | unavailable |
| P-467883463 | 95 | Main component | by synthesis |
| P-14083800 | 90 | Main component | 11 mg |
| P-580496079 | 98 | Main component | by synthesis |
| P-852454201 | N/A | Main component | in stock |
| P-428093185 | 95 | Main component | 19.934 kg |
| P-854738687 | 95 | Main component | in stock |
| P-12324234 | 90 | Main component | 59 mg |
| P-454369031 | 92 | Main component | in stock |
| P-864651477 | 92 | Main component | 300 mg |
| P-500373850 | 98 | Main component | by synthesis |
| P-885538685 | 95 | Main component | by synthesis |
| P-18946139 | 90 | Main component | in stock |
| P-896074021 | N/A | Main component | 3.468 g |
| P-502357911 | 90 | Main component | in stock |
| P-888359728 | 94 | Main component | by resynthesis (? - ? days) |
| P-3240318 | 90 | Main component | 2.874 g |
| P-615394872 | 95 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 168.622 |
| logP | 2.6733 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 0 |
| PSA | 28.68 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 48.0247 |
| Atoms | 20 |
| Rings | 2 |
| Heavy atoms | 11 |
| Hydrogen atoms | 9 |
| Heteroatoms | 3 |
| N/O atoms | 2 |
| 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 |
