Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1090730500
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 | 44 USD | 90 | 21 working days | Get Quote |
| 5 mg | 71 USD | 90 | 21 working days | Get Quote |
| 10 mg | 86 USD | 90 | 21 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-1090730500.sdf |
| SMILES | MCULE-1090730500.smiles |
| Standard InChI | MCULE-1090730500.inchi |
| InChIKey | MCULE-1090730500.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-875704297 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-590404083 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-893430720 | Advanced ChemBlocks Inc (AChemBlock) | On demand | 90 | As is | by synthesis |
| P-580264706 | Aldlab Chemicals | Building Block Custom Synth | 95 | As is | by synthesis |
| P-851582074 | AmBeed | On request | N/A | As is | by synthesis |
| P-489220974 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-864215000 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-590820341 | BLD pharm | Non-stock building blocks | 98 | As is | by synthesis |
| P-577088606 | Chemcia | Virtual compounds | 95 | As is | by synthesis |
| P-851265214 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-861491973 | Combi-Blocks | Building Block on demand | 99 | As is | by synthesis |
| P-861980998 | FluoroChem | General BB | 97 | As is | in stock |
| P-862262761 | KISHIDA CHEMICAL | K-BB | 95 | As is | 1.98 g |
| P-454402793 | Key Organics | Building Blocks | 97 | As is | 3.215 g |
| P-18812496 | Key Organics | Screening Compounds and Fragments | 97 | As is | 3.215 g |
| P-852445132 | Matrix Scientific | All | N/A | As is | in stock |
| P-519760642 | Maybridge | Maybridge Building Blocks | 97 | As is | 52.7 g |
| P-428003484 | Maybridge | Screening Collection | 90 | As is | 52.7 kg |
| P-854770526 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-492277250 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 1.796 g |
| P-26407097 | Otava | In-House Stock Library | 90 | As is | 1.796 g |
| P-502360083 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611532771 | Toronto Research | In stock | 90 | As is | in stock |
| P-886950140 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 164.161 |
| logP | 1.3189 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 0 |
| PSA | 64.35 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 47.6651 |
| Atoms | 20 |
| Rings | 2 |
| Heavy atoms | 12 |
| Hydrogen atoms | 8 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| 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 |
