Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3899419884
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 | 35 USD | 90 | 19 working days | Get Quote |
| 5 mg | 45 USD | 98 | 16 working days | Get Quote |
| 10 mg | 45 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.
-
MCULE-6846784607
- Component type: Main
-
MCULE-3955575945
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-3899419884.sdf |
| SMILES | MCULE-3899419884.smiles |
| Standard InChI | MCULE-3899419884.inchi |
| InChIKey | MCULE-3899419884.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-666899892 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 5 mg |
| P-579624210 | LabSeeker, Inc | Stock Collection | 95 | As is | in stock |
| P-868130050 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-894004306 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| P-619331727 | ChemDiv | Discovery Chemistry Library | 90 | As a main component | 371 mg |
| P-500417908 | Glentham Life Sciences | Compounds maintained in stock | N/A | As a main component | in stock |
| P-500417910 | Glentham Life Sciences | Compounds maintained in stock | 1645 | As a main component | in stock |
| P-870662200 | Glentham Life Sciences | Compounds typically in stock | 96 | As a main component | in stock |
| P-870662205 | Glentham Life Sciences | Compounds typically in stock | 1440 | As a main component | in stock |
| P-870662222 | Glentham Life Sciences | Compounds typically in stock | 96 | As a main component | in stock |
| P-855918777 | Key Organics | Building Blocks | 97 | As a main component | 500 g |
| P-608270106 | Molnova | Stock | 98 | As a main component | in stock |
| P-675078796 | Princeton Biomolecular Research | Screening Compounds | 90 | As a main component | in stock |
| P-885540646 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As a main component | by synthesis |
| P-885559465 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As a main component | by synthesis |
| P-33300384 | TimTec | ActiMol 2 Week | 90 | As a main component | in stock |
| P-33369969 | TimTec | ActiMol 2 Week | 90 | As a main component | in stock |
| P-617748163 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As a main component | 415 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 334.392 |
| logP | 1.1896 |
| H-bond acceptors | 6 |
| H-bond donors | 2 |
| Rotatable bonds | 5 |
| PSA | 112.01 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 89.8565 |
| Atoms | 41 |
| Rings | 3 |
| Heavy atoms | 23 |
| Hydrogen atoms | 18 |
| Heteroatoms | 7 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 3 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 3 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
