Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1966421103
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 | 98 | 14 working days | Get Quote |
| 5 mg | 5 USD | 98 | 14 working days | Get Quote |
| 10 mg | 5 USD | 98 | 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-1966421103.sdf |
| SMILES | MCULE-1966421103.smiles |
| Standard InChI | MCULE-1966421103.inchi |
| InChIKey | MCULE-1966421103.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867586408 | 97 | As is | in stock |
| P-875745004 | N/A | As is | in stock |
| P-535627046 | 95 | As is | in stock |
| P-869247425 | 99 | As is | in stock |
| P-535624905 | 98 | As is | in stock |
| P-505400951 | 98 | As is | in stock |
| P-903075564 | 98 | As is | 136 kg |
| P-875896468 | N/A | As is | in stock |
| P-606905264 | N/A | As is | in stock |
| P-489126231 | 97 | As is | in stock |
| P-596954352 | 98 | As is | 109.5 kg |
| P-579791139 | 95 | As is | 61 g |
| P-864090928 | 97 | As is | in stock |
| P-851274145 | 95 | As is | by synthesis |
| P-868600739 | 98 | As is | in stock |
| P-580423537 | 95 | As is | by resynthesis (? - ? days) |
| P-901366558 | 97 | As is | 430.5 g |
| P-905327727 | 97 | As is | 156 g |
| P-524169755 | 98 | As is | 500 g |
| P-608080141 | 95 | As is | 500 g |
| P-580512992 | 98 | As is | 829 g |
| P-852428163 | N/A | As is | in stock |
| P-854725627 | 95 | As is | in stock |
| P-500392653 | 98 | As is | by synthesis |
| P-889885321 | 95 | As is | by synthesis |
| P-498682304 | 95 | As is | 680 g |
| P-502391813 | 90 | As is | in stock |
| P-611477797 | 90 | As is | in stock |
| P-575312101 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 150.105 |
| logP | -0.3295 |
| H-bond acceptors | 4 |
| H-bond donors | 0 |
| Rotatable bonds | 4 |
| PSA | 52.6 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 28.77 |
| Atoms | 17 |
| Rings | 0 |
| Heavy atoms | 10 |
| Hydrogen atoms | 7 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| 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 |
