Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3299223173-0
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 | 6 USD | 98 | 14 working days | Get Quote |
| 5 mg | 6 USD | 98 | 14 working days | Get Quote |
| 10 mg | 6 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-6670904388-0
- Component type: Main
-
1
MCULE-7728164114-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-3299223173-0.sdf |
| SMILES | MCULE-3299223173-0.smiles |
| Standard InChI | MCULE-3299223173-0.inchi |
| InChIKey | MCULE-3299223173-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-1263082111 | N/A | As is | by synthesis |
| P-905610446 | 98 | As is | by synthesis |
| P-905144337 | 95 | As is | in stock |
| P-867561757 | 98 | Main component | in stock |
| P-875722242 | N/A | Main component | in stock |
| P-869183577 | 95 | Main component | in stock |
| P-505354140 | 98 | Main component | in stock |
| P-505388964 | 99 | Main component | in stock |
| P-903051536 | 98 | Main component | 6 kg |
| P-606938851 | N/A | Main component | in stock |
| P-596945725 | 98 | Main component | 25 kg |
| P-580194998 | 98 | Main component | in stock |
| P-579788093 | 95 | Main component | 556.5 g |
| P-864085285 | 97 | Main component | in stock |
| P-889739141 | 95 | Main component | 100 g |
| P-580721419 | 98 | Main component | 2.085 kg |
| P-900267680 | N/A | Main component | by resynthesis (? - ? days) |
| P-901519465 | 95 | Main component | by synthesis |
| P-893218625 | 95 | Main component | in stock |
| P-505573410 | 98 | Main component | in stock |
| P-893361553 | 90 | Main component | 1000 mg |
| P-454753911 | 90 | Main component | in stock |
| P-881631368 | 98 | Main component | in stock |
| P-436478021 | 95 | Main component | 55 g |
| P-34909942 | 90 | Main component | in stock |
| P-851268409 | 95 | Main component | by synthesis |
| P-580450428 | 99 | Main component | in stock |
| P-868592623 | 98 | Main component | in stock |
| P-500418251 | 99 | Main component | in stock |
| P-505494890 | 95 | Main component | in stock |
| P-492243036 | 95 | Main component | in stock |
| P-488556031 | 92 | Main component | in stock |
| P-488546861 | 90 | Main component | in stock |
| P-524441081 | 97 | Main component | 508 mg |
| P-873390096 | 98 | Main component | unavailable |
| P-608082673 | 98 | Main component | 5 kg |
| P-31194983 | 90 | Main component | unavailable |
| P-894572899 | 95 | Main component | 5.604 g |
| P-131341037 | 90 | Main component | 5.604 g |
| P-580517431 | 98 | Main component | 1000 g |
| P-852426739 | N/A | Main component | in stock |
| P-854719483 | 95 | Main component | in stock |
| P-901013678 | 95 | Main component | in stock |
| P-474027608 | 95 | Main component | in stock |
| P-608276848 | 98 | Main component | in stock |
| P-454366643 | 92 | Main component | in stock |
| P-500374448 | 98 | Main component | by synthesis |
| P-1263956279 | 90 | Main component | in stock |
| P-1263959250 | 90 | Main component | in stock |
| P-885523064 | 95 | Main component | by synthesis |
| P-19098104 | 90 | Main component | in stock |
| P-579711457 | N/A | Main component | in stock |
| P-904256126 | 95 | Main component | in stock |
| P-869110629 | 95 | Main component | by synthesis |
| P-892287602 | 95 | Main component | 2.076 g |
| P-888628837 | 95 | Main component | 2.076 g |
| P-502385721 | 90 | Main component | in stock |
| P-33162216 | 90 | Main component | 1000 mg |
| P-906778588 | 98 | Main component | by synthesis |
| P-825232 | 90 | Main component | 11.875 g |
| P-3221698 | 90 | Main component | 11.875 g |
| P-666970180 | 95 | Main component | in stock |
| P-895216054 | 95 | Main component as a main component | by synthesis |
| P-904369573 | 95 | Main component as a main component | in stock |
| P-904222073 | 95 | Main component as a main component | by synthesis |
| P-904238713 | 95 | Main component as a main component | unavailable |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 326.777 |
| logP | 3.222 |
| H-bond acceptors | 7 |
| H-bond donors | 2 |
| Rotatable bonds | 5 |
| PSA | 105.51 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 86.7348 |
| Atoms | 41 |
| Rings | 2 |
| Heavy atoms | 22 |
| Hydrogen atoms | 19 |
| Heteroatoms | 8 |
| N/O atoms | 7 |
| 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 |
