Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9805827315-0
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 | 97 | 14 working days | Get Quote |
| 5 mg | 5 USD | 97 | 14 working days | Get Quote |
| 10 mg | 5 USD | 97 | 14 working days | Get Quote |
- 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-6315626505-0
- Component type: Unknown
| Name | File |
|---|---|
| SDF | MCULE-9805827315-0.sdf |
| SMILES | MCULE-9805827315-0.smiles |
| Standard InChI | MCULE-9805827315-0.inchi |
| InChIKey | MCULE-9805827315-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867579057 | 97 | As is | in stock |
| P-875738452 | 97 | As is | in stock |
| P-597023951 | 97 | As is | unavailable |
| P-1275152029 | 97 | As is | in stock |
| P-1275191977 | 98 | As is | in stock |
| P-903068645 | 97 | As is | 1000 g |
| P-905482984 | 97 | As is | 1000 mg |
| P-893512620 | 90 | As is | 1.33379 kg |
| P-1270349544 | 97 | As is | in stock |
| P-580200269 | 95 | As is | 2 g |
| P-617065604 | 95 | As is | in stock |
| P-606849264 | N/A | As is | in stock |
| P-489154602 | 97 | As is | in stock |
| P-596951934 | 97 | As is | 200 g |
| P-866726668 | 95 | As is | 90 g |
| P-864120499 | 95 | As is | in stock |
| P-481171861 | 95 | As is | 49 g |
| P-580716877 | 97 | As is | 122.5 g |
| P-851270043 | 95 | As is | by synthesis |
| P-851287357 | 95 | As is | by synthesis |
| P-868582692 | 98 | As is | in stock |
| P-580424470 | 95 | As is | by resynthesis (? - ? days) |
| P-861967956 | 97 | As is | 541.287 g |
| P-905333433 | 97 | As is | 25 g |
| P-901379059 | 97 | As is | 4 g |
| P-505514358 | 95 | As is | in stock |
| P-502529043 | 95 | As is | by synthesis |
| P-454287418 | 90 | As is | 984 mg |
| P-579618877 | 95 | As is | in stock |
| P-580511611 | 98 | As is | in stock |
| P-1272579376 | 95 | As is | 200 g |
| P-852441431 | 95 | As is | by synthesis |
| P-500398778 | 97 | As is | by synthesis |
| P-896082386 | N/A | As is | 2.493 g |
| P-498649474 | 95 | As is | 369.2 g |
| P-502362402 | 90 | As is | in stock |
| P-906771959 | 98 | As is | by synthesis |
| P-894978144 | 85 | As is | in stock |
| P-1271725247 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 200.032 |
| logP | 2.0467 |
| H-bond acceptors | 2 |
| H-bond donors | 0 |
| Rotatable bonds | 1 |
| PSA | 29.96 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 42.1315 |
| Atoms | 16 |
| Rings | 1 |
| Heavy atoms | 10 |
| Hydrogen atoms | 6 |
| Heteroatoms | 3 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
