Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3034710731
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 | 18 USD | 90 | 14 working days | Get Quote |
| 5 mg | 27 USD | 90 | 14 working days | Get Quote |
| 10 mg | 37 USD | 90 | 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.
| Name | File |
|---|---|
| SDF | MCULE-3034710731.sdf |
| SMILES | MCULE-3034710731.smiles |
| Standard InChI | MCULE-3034710731.inchi |
| InChIKey | MCULE-3034710731.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-612921997 | A2B Chem | Predominantly Building Block on demand | 95 | As is | by synthesis |
| P-889906017 | AA Blocks | AA Blocks - synthesis | N/A | As is | by synthesis |
| P-853439766 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-675064082 | Alinda | Building Blocks | 95 | As is | 30 g |
| P-851818727 | AmBeed | On request | N/A | As is | by synthesis |
| P-611202284 | BLD pharm | Non-stock building blocks | 97 | As is | by synthesis |
| P-577179198 | ChemDiv | Building Blocks on demand | 90 | As is | by synthesis |
| P-887327976 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-889111195 | FluoroChem | In Stock BB | N/A | As is | 4 g |
| P-492236845 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-488552977 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-13809311 | InterBioScreen | Screening Compounds | 92 | As is | 300 mg |
| P-18782883 | Key Organics | Screening Compounds and Fragments | 90 | As is | 108 mg |
| P-500223493 | LeadGen Labs | In-stock compounds | 96 | As is | in stock |
| P-852469185 | Matrix Scientific | All | N/A | As is | in stock |
| P-35161418 | Maybridge | Screening Collection | 90 | As is | 12.59 kg |
| P-874438577 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-579724225 | Menai Organics | Building blocks | 90 | As is | in stock |
| P-579726190 | Menai Organics | Screening compounds | 90 | As is | in stock |
| P-454373205 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
| P-519970779 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-885529725 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-502370179 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611366236 | Toronto Research | In stock | 90 | As is | in stock |
| P-464685488 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 1.023 g |
| P-3153097 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1.023 g |
| P-615418608 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 248.687 |
| logP | 2.6412 |
| H-bond acceptors | 5 |
| H-bond donors | 2 |
| Rotatable bonds | 3 |
| PSA | 101.13 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 56.4749 |
| Atoms | 24 |
| Rings | 1 |
| Heavy atoms | 15 |
| Hydrogen atoms | 9 |
| Heteroatoms | 7 |
| N/O atoms | 5 |
| 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 | 1 |
| Cis/trans stereo double bonds | 1 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
