Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2987387540
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 | 13 USD | 97 | 11 working days | Get Quote |
| 5 mg | 13 USD | 97 | 11 working days | Get Quote |
| 10 mg | 13 USD | 97 | 11 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-2987387540.sdf |
| SMILES | MCULE-2987387540.smiles |
| Standard InChI | MCULE-2987387540.inchi |
| InChIKey | MCULE-2987387540.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867575199 | A2B Chem | Predominantly Building Block in stock | 94 | As is | in stock |
| P-867525683 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-875735338 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-579760661 | AK Scientific | Building Blocks | 97 | As is | in stock |
| P-893428465 | Advanced ChemBlocks Inc (AChemBlock) | On demand | 90 | As is | by synthesis |
| P-606838557 | AmBeed | In stock | N/A | As is | in stock |
| P-489105615 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-494329915 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-901333789 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-901918952 | BLD pharm | In-stock building blocks | 97 | As is | 252.4 g |
| P-893242959 | Biosynth | In Stock | 95 | As is | in stock |
| P-872748379 | Combi-Blocks | Building Block in stock | 97 | As is | in stock |
| P-872749334 | Combi-Blocks | Building Block in stock | 97 | As is | in stock |
| P-580272716 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-889110031 | FluoroChem | In Stock BB | N/A | As is | 15 g |
| P-563570390 | Key Organics | Building Blocks | 95 | As is | 100 g |
| P-31259970 | LaboTest | Screening Collection | 90 | As is | 200 mg |
| P-596714091 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 1000 mg |
| P-611496628 | Toronto Research | In stock | 90 | As is | in stock |
| P-480398921 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 155.115 |
| logP | 0.9069 |
| H-bond acceptors | 7 |
| H-bond donors | 3 |
| Rotatable bonds | 1 |
| PSA | 127.48 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 38.3188 |
| Atoms | 16 |
| Rings | 1 |
| Heavy atoms | 11 |
| Hydrogen atoms | 5 |
| Heteroatoms | 7 |
| N/O atoms | 7 |
| 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 |
