Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9720356859
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 | 7 USD | 98 | 14 working days | Get Quote |
| 5 mg | 7 USD | 98 | 14 working days | Get Quote |
| 10 mg | 7 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.
-
MCULE-3550918497
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-9720356859.sdf |
| SMILES | MCULE-9720356859.smiles |
| Standard InChI | MCULE-9720356859.inchi |
| InChIKey | MCULE-9720356859.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867639583 | 98 | As is | in stock |
| P-875804755 | N/A | As is | in stock |
| P-869192337 | 95 | As is | in stock |
| P-505388930 | 99 | As is | in stock |
| P-505389659 | 98 | As is | in stock |
| P-903161885 | 98 | As is | 1000 g |
| P-606845428 | N/A | As is | in stock |
| P-596968461 | 99 | As is | 1000 g |
| P-580195127 | 98 | As is | in stock |
| P-864195794 | 95 | As is | in stock |
| P-580701085 | 98 | As is | 138 g |
| P-893237903 | 95 | As is | in stock |
| P-851268300 | 95 | As is | by synthesis |
| P-580450424 | 99 | As is | in stock |
| P-868576594 | 98 | As is | in stock |
| P-608498826 | 95 | As is | in stock |
| P-905314633 | 95 | As is | in stock |
| P-861971559 | 95 | As is | 513.859 g |
| P-870653028 | N/A | As is | in stock |
| P-505493658 | 95 | As is | in stock |
| P-596548721 | 98 | As is | 100 mg |
| P-856044317 | 90 | As is | 10 g |
| P-31194944 | 90 | As is | 10 g |
| P-904073497 | 95 | As is | in stock |
| P-854713823 | 95 | As is | in stock |
| P-474027454 | 95 | As is | in stock |
| P-608276426 | 98 | As is | in stock |
| P-630775190 | 90 | As is | by synthesis |
| P-500375434 | 99 | As is | by synthesis |
| P-885536454 | 95 | As is | by synthesis |
| P-579710952 | N/A | As is | in stock |
| P-869109053 | 95 | As is | by synthesis |
| P-892287134 | 95 | As is | 1.734 g |
| P-888627813 | 95 | As is | 1.734 g |
| P-502366294 | 90 | As is | in stock |
| P-893965299 | 95 | As is | in stock |
| P-885908680 | 98 | As a main component | by synthesis |
| P-872725204 | 98 | As a main component | in stock |
| P-893218223 | 95 | As a main component | in stock |
| P-855235290 | 90 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 270.350 |
| logP | 3.6456 |
| H-bond acceptors | 5 |
| H-bond donors | 2 |
| Rotatable bonds | 7 |
| PSA | 83.65 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 69.9224 |
| Atoms | 36 |
| Rings | 1 |
| Heavy atoms | 18 |
| Hydrogen atoms | 18 |
| Heteroatoms | 6 |
| N/O atoms | 5 |
| 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 |
