Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7952633598
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 | 5 USD | 97 | 20 working days | Get Quote |
| 5 mg | 5 USD | 97 | 20 working days | Get Quote |
| 10 mg | 5 USD | 97 | 20 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-7952633598.sdf |
| SMILES | MCULE-7952633598.smiles |
| Standard InChI | MCULE-7952633598.inchi |
| InChIKey | MCULE-7952633598.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867585971 | A2B Chem | Predominantly Building Block in stock | 97 | As is | in stock |
| P-875744961 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869192354 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-505346781 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-580232884 | Aldlab Chemicals | Building Block Custom Synth | 95 | As is | by synthesis |
| P-606947761 | AmBeed | In stock | N/A | As is | in stock |
| P-596954313 | Angene | Building Blocks in stock | 97 | As is | 2.187 kg |
| P-494329020 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-864164171 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-580698393 | BLD pharm | In-stock building blocks | 97 | As is | 141 g |
| P-4161971 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 25 mg |
| P-851255718 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868615579 | Combi-Blocks | Building Block in stock | 95 | As is | in stock |
| P-862032379 | FluoroChem | General BB | N/A | As is | in stock |
| P-505493646 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-854062624 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-12357782 | InterBioScreen | Screening Compounds | 92 | As is | 214 mg |
| P-524161197 | Key Organics | Building Blocks | 98 | As is | 25 g |
| P-613281340 | Life Chemicals | Building Blocks - virtual | 95 | As is | by synthesis |
| P-852426835 | Matrix Scientific | All | N/A | As is | in stock |
| P-863719987 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-674718269 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
| P-424840266 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-885535568 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-502385791 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611457574 | Toronto Research | In stock | 90 | As is | in stock |
| P-25557059 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 150 mg |
| P-615397592 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 216.231 |
| logP | 0.7079 |
| H-bond acceptors | 5 |
| H-bond donors | 0 |
| Rotatable bonds | 8 |
| PSA | 69.67 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 52.954 |
| Atoms | 31 |
| Rings | 0 |
| Heavy atoms | 15 |
| Hydrogen atoms | 16 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
