Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3479095250
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 | 6 USD | 98 | 14 working days | Get Quote |
| 5 mg | 6 USD | 98 | 14 working days | Get Quote |
| 10 mg | 6 USD | 98 | 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.
| Name | File |
|---|---|
| SDF | MCULE-3479095250.sdf |
| SMILES | MCULE-3479095250.smiles |
| Standard InChI | MCULE-3479095250.inchi |
| InChIKey | MCULE-3479095250.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867568167 | 98 | As is | in stock |
| P-875728172 | 98 | As is | in stock |
| P-597027882 | 95 | As is | unavailable |
| P-1275145345 | 95 | As is | in stock |
| P-1275186152 | 98 | As is | in stock |
| P-903057654 | 98 | As is | 1000 g |
| P-905485570 | 98 | As is | 100 g |
| P-1270378534 | 98 | As is | in stock |
| P-580200401 | 95 | As is | 30 g |
| P-606930492 | N/A | As is | in stock |
| P-596987546 | 98 | As is | 1000 g |
| P-494345736 | 95 | As is | 6.9 kg |
| P-864084821 | 97 | As is | in stock |
| P-584628518 | 98 | As is | 560 g |
| P-901450989 | 95 | As is | by synthesis |
| P-454639989 | 90 | As is | in stock |
| P-851259384 | 95 | As is | by synthesis |
| P-868641309 | 98 | As is | in stock |
| P-580418084 | 95 | As is | by resynthesis (? - ? days) |
| P-579805191 | 90 | As is | in stock |
| P-861921137 | 95 | As is | 2.47149 kg |
| P-905328359 | 95 | As is | 430 g |
| P-870657916 | N/A | As is | in stock |
| P-492220310 | 95 | As is | in stock |
| P-502742729 | 90 | As is | in stock |
| P-583850333 | 90 | As is | in stock |
| P-12488608 | 92 | As is | 203 mg |
| P-454390906 | 95 | As is | 21.86 g |
| P-454295405 | 95 | As is | 100 mg |
| P-579611219 | 95 | As is | in stock |
| P-856012467 | 90 | As is | unavailable |
| P-613282068 | 95 | As is | by synthesis |
| P-580483220 | 98 | As is | by synthesis |
| P-852377364 | N/A | As is | by synthesis |
| P-1272561764 | N/A | As is | in stock |
| P-428002376 | 90 | As is | in stock |
| P-1267010211 | 95 | As is | in stock |
| P-12415997 | 90 | As is | 500 mg |
| P-581758844 | 92 | As is | in stock |
| P-23813162 | 92 | As is | 203 mg |
| P-500370310 | 99 | As is | by synthesis |
| P-885531507 | 95 | As is | by synthesis |
| P-19151829 | 90 | As is | in stock |
| P-22815785 | 90 | As is | in stock |
| P-502354732 | 90 | As is | in stock |
| P-903643649 | 94 | As is | by resynthesis (? - ? days) |
| P-906754864 | 98 | As is | by synthesis |
| P-611365777 | 90 | As is | in stock |
| P-1248789 | 90 | As is | 11 mg |
| P-1279191153 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 137.179 |
| logP | 1.3848 |
| H-bond acceptors | 2 |
| H-bond donors | 2 |
| Rotatable bonds | 2 |
| PSA | 46.25 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 41.7812 |
| Atoms | 21 |
| Rings | 1 |
| Heavy atoms | 10 |
| Hydrogen atoms | 11 |
| 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 |
