Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2413701614
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 | 46 USD | 90 | 21 working days | Get Quote |
| 5 mg | 65 USD | 98 | 11 working days | Get Quote |
| 10 mg | 65 USD | 98 | 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.
-
MCULE-1099993202
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-2413701614.sdf |
| SMILES | MCULE-2413701614.smiles |
| Standard InChI | MCULE-2413701614.inchi |
| InChIKey | MCULE-2413701614.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-886646760 | A2B Chem | Predominantly Building Block in stock | N/A | As is | in stock |
| P-890165544 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-588246230 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-596508417 | Asinex | General bb catalog | 90 | As is | 1000 mg |
| P-596275350 | Asinex | General screening catalog | 90 | As is | 1000 mg |
| P-889798571 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-454677618 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-436440723 | Chemical Block | Building Blocks | 90 | As is | 1.891 kg |
| P-887120387 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-580423023 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-590340359 | HTS Biochemie Innovationen GmbH | Stock Compounds | 90 | As is | 1000 mg |
| P-890217926 | HTS Biochemie Innovationen GmbH | Building Blocks | 90 | As is | in stock |
| P-505498355 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-900955760 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-502535437 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-579674029 | LabSeeker, Inc | On demand Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-852395154 | Matrix Scientific | All | N/A | As is | in stock |
| P-620139656 | Otava | In-House Stock Library | 90 | As is | 1000 mg |
| P-620233796 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 1000 mg |
| P-500380298 | Pi Chemicals | Virtual Compounds | 95 | As is | by synthesis |
| P-611599379 | Toronto Research | In stock | 90 | As is | in stock |
| P-889509575 | AstaTech | Backordered BBs | 95 | As a main component | by synthesis |
| P-901475928 | Biosynth | Synthesis | 95 | As a main component | by synthesis |
| P-852388188 | Matrix Scientific | All | N/A | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 209.284 |
| logP | 2.6855 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 6 |
| PSA | 44.48 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 61.5204 |
| Atoms | 34 |
| Rings | 1 |
| Heavy atoms | 15 |
| Hydrogen atoms | 19 |
| 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 |
