Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5132845727
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 | 5 USD | 95 | 10 working days | Get Quote |
| 5 mg | 5 USD | 95 | 10 working days | Get Quote |
| 10 mg | 5 USD | 95 | 10 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-1590375970
- Component type: Unknown
-
MCULE-6949656709
- Component type: Main
-
MCULE-9985902220
- Component type: Main
-
MCULE-1617397213
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-5132845727.sdf |
| SMILES | MCULE-5132845727.smiles |
| Standard InChI | MCULE-5132845727.inchi |
| InChIKey | MCULE-5132845727.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867428587 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-869195096 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-505347727 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-505404039 | AK Scientific | Building Blocks | 99 | As is | in stock |
| P-888701506 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-580198112 | Aldlab Chemicals | Building Block Stock | 95 | As is | 108 g |
| P-606922278 | AmBeed | In stock | N/A | As is | in stock |
| P-494346237 | Apollo Scientific | In Stock | 95 | As is | 249.9 g |
| P-889740810 | Atlantic Research Chemicals Ltd | In-stock Building Blocks | 95 | As is | 300 g |
| P-580710631 | BLD pharm | In-stock building blocks | 95 | As is | 4.45 kg |
| P-893229767 | Biosynth | In Stock | 95 | As is | in stock |
| P-452655392 | Chemfaces | Natural Compounds | 98 | As is | in stock |
| P-868576627 | Combi-Blocks | Building Block in stock | 95 | As is | in stock |
| P-868661710 | DC Chemicals Limited | Stock Products | 95 | As is | in stock |
| P-862001838 | FluoroChem | General BB | 95 | As is | in stock |
| P-870655651 | Glentham Life Sciences | Compounds typically in stock | N/A | As is | in stock |
| P-890209325 | HTS Biochemie Innovationen GmbH | Building Blocks | 90 | As is | in stock |
| P-579511500 | HTS Biochemie Innovationen GmbH | Stock Compounds | 90 | As is | 12 g |
| P-492217470 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-504609415 | Innovapharm | Virtual Screening Compounds | 90 | As is | by synthesis |
| P-488550384 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-856009805 | Key Organics | Biochemicals | 95 | As is | unavailable |
| P-454398910 | Key Organics | Building Blocks | 95 | As is | 1.002 g |
| P-454312276 | Key Organics | Screening Compounds and Fragments | 95 | As is | 1.002 g |
| P-856041490 | LaboTest | Building Blocks | 90 | As is | unavailable |
| P-31226530 | LaboTest | Screening Collection | 90 | As is | unavailable |
| P-613284183 | Life Chemicals | Building Blocks - virtual | 95 | As is | by synthesis |
| P-852505489 | Matrix Scientific | All | N/A | As is | in stock |
| P-428011887 | Maybridge | Screening Collection | 95 | As is | 10.682 kg |
| P-896629585 | MedChemExpress | Screening compounds on demand | 95 | As is | by synthesis |
| P-854691797 | MedChemExpress | Natural Products In stock | 95 | As is | in stock |
| P-584613774 | MedKoo | In stock compounds | 95 | As is | in stock |
| P-619673282 | Molnova | Stock | 98 | As is | in stock |
| P-492279878 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 249.983 g |
| P-12680634 | Otava | In-House Stock Library | 90 | As is | 249.983 g |
| P-454368768 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
| P-19391020 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-885523340 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-617402377 | Selleckchem | Product Catalog | N/A | As is | in stock |
| P-896077118 | Specs | Repurposed Compounds | N/A | As is | 95.876 g |
| P-596771527 | Synthonix | In-stock Building Blocks | 95 | As is | 61.2203 kg |
| P-594274542 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-869177643 | TargetMol | Natural Products | 95 | As is | in stock |
| P-892296037 | TargetMol | In Stock BB | 95 | As is | 1000 mg |
| P-892338427 | TargetMol | Screening Compounds - stock amount | 95 | As is | 1000 mg |
| P-502329695 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-3239184 | VITAS M CHEMICAL LIMITED | Collections of Fragments for Fragment-based Drug Discovery | 90 | As is | 1.361 g |
| P-3226419 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 1.361 g |
| P-25009313 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1.361 g |
| P-590433056 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| P-893105495 | A2B Chem | Predominantly Building Block on demand | N/A | As a main component | by synthesis |
| P-860650503 | A2B Chem | Predominantly Building Block on demand | N/A | As a main component | by synthesis |
| P-853433034 | AK Scientific | Building Blocks | 98 | As a main component | in stock |
| P-853433036 | AK Scientific | Building Blocks | 98 | As a main component | in stock |
| P-851474820 | AmBeed | On request | N/A | As a main component | by synthesis |
| P-851711308 | AmBeed | On request | N/A | As a main component | by synthesis |
| P-590777638 | BLD pharm | Non-stock building blocks | 97 | As a main component | by synthesis |
| P-590925068 | BLD pharm | Non-stock building blocks | 97 | As a main component | by synthesis |
| P-504021529 | Innovapharm | Virtual Screening Compounds | 90 | As a main component | by synthesis |
| P-504021961 | Innovapharm | Virtual Screening Compounds | 90 | As a main component | by synthesis |
| P-504022355 | Innovapharm | Virtual Screening Compounds | 90 | As a main component | by synthesis |
| P-895518997 | MedChemExpress | Building Blocks on demand | 95 | As a main component | by synthesis |
| P-895525123 | MedChemExpress | Building Blocks on demand | 95 | As a main component | by synthesis |
| P-886924977 | eNovation Chemicals LLC | Building Block on demand | 95 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 112.083 |
| logP | 0.9778 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 50.44 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 25.6673 |
| Atoms | 12 |
| Rings | 1 |
| Heavy atoms | 8 |
| Hydrogen atoms | 4 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| 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 |
