Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1035082824-1
Structure
Show compound
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 | 14 working days | Get Quote |
| 5 mg | 5 USD | 95 | 14 working days | Get Quote |
| 10 mg | 5 USD | 95 | 14 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-1035082824-1.sdf |
| SMILES | MCULE-1035082824-1.smiles |
| Standard InChI | MCULE-1035082824-1.inchi |
| InChIKey | MCULE-1035082824-1.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867533483 | 95 | As is | in stock |
| P-875687792 | N/A | As is | in stock |
| P-874620312 | 98 | As is | in stock |
| P-903007273 | 95 | As is | 200 g |
| P-580242371 | 95 | As is | by synthesis |
| P-606859908 | N/A | As is | in stock |
| P-489136654 | 97 | As is | in stock |
| P-596925729 | 95 | As is | 900 g |
| P-864114287 | 95 | As is | in stock |
| P-517094041 | 90 | As is | in stock |
| P-871214983 | 95 | As is | by synthesis |
| P-868597132 | 98 | As is | in stock |
| P-889116693 | 98 | As is | 68.4 g |
| P-862045904 | 98 | As is | 1.40075 kg |
| P-905348204 | 98 | As is | 400 g |
| P-870653176 | N/A | As is | in stock |
| P-492216877 | 95 | As is | in stock |
| P-26427525 | 90 | As is | 5.994 g |
| P-492279070 | 95 | As is | 5.994 g |
| P-888875624 | N/A | As is | in stock |
| P-500381291 | 98 | As is | by synthesis |
| P-885538860 | 95 | As is | by synthesis |
| P-596785242 | 95 | As is | 140 g |
| P-23335925 | 90 | As is | in stock |
| P-502352328 | 90 | As is | in stock |
| P-888433163 | 94 | As is | by resynthesis (? - ? days) |
| P-906845424 | 99 | As is | by synthesis |
| P-611437488 | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 109.126 |
| logP | 0.6833 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 0 |
| PSA | 32.86 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 32.0287 |
| Atoms | 15 |
| Rings | 1 |
| Heavy atoms | 8 |
| Hydrogen atoms | 7 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| 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 |
