Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9829635593
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 | 7 USD | 95 | 14 working days | Get Quote |
| 5 mg | 7 USD | 95 | 14 working days | Get Quote |
| 10 mg | 7 USD | 95 | 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-1529487582
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-9829635593.sdf |
| SMILES | MCULE-9829635593.smiles |
| Standard InChI | MCULE-9829635593.inchi |
| InChIKey | MCULE-9829635593.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867584786 | 95 | As is | in stock |
| P-875742892 | 95 | As is | in stock |
| P-597026375 | 95 | As is | unavailable |
| P-590393440 | 95 | As is | by resynthesis (? - ? days) |
| P-903073438 | 95 | As is | 75 g |
| P-893532030 | 90 | As is | in stock |
| P-1270318049 | 95 | As is | in stock |
| P-580240168 | 95 | As is | by synthesis |
| P-606875104 | N/A | As is | in stock |
| P-489163368 | 97 | As is | in stock |
| P-489196023 | 97 | As is | in stock |
| P-596953824 | 96 | As is | 30 g |
| P-494349774 | 95 | As is | 1.7 g |
| P-596438639 | 90 | As is | 27 mg |
| P-864103740 | 95 | As is | in stock |
| P-580710378 | 95 | As is | 36 g |
| P-1275211804 | 95 | As is | in stock |
| P-893253169 | 95 | As is | by synthesis |
| P-504803685 | 90 | As is | 1 mg |
| P-454683644 | 90 | As is | in stock |
| P-448743566 | 90 | As is | 15 mg |
| P-436442739 | 90 | As is | 5.485 g |
| P-337642 | 90 | As is | 422 mg |
| P-436452068 | 95 | As is | in stock |
| P-34858848 | 90 | As is | in stock |
| P-851264685 | 95 | As is | by synthesis |
| P-868592141 | 98 | As is | in stock |
| P-34728719 | 90 | As is | by synthesis |
| P-580410885 | 95 | As is | by resynthesis (? - ? days) |
| P-861985454 | 96 | As is | 77.417 g |
| P-1264341716 | 96 | As is | 2 g |
| P-502507084 | 95 | As is | by synthesis |
| P-454403093 | 95 | As is | 105 mg |
| P-454322784 | 95 | As is | 105 mg |
| P-871258883 | 95 | As is | in stock |
| P-580493205 | 97 | As is | by synthesis |
| P-852386443 | N/A | As is | by synthesis |
| P-1272566411 | N/A | As is | in stock |
| P-35256334 | 95 | As is | in stock |
| P-854712480 | 95 | As is | in stock |
| P-889862224 | 95 | As is | by synthesis |
| P-19093516 | 90 | As is | in stock |
| P-498639743 | 95 | As is | by synthesis |
| P-596756773 | 95 | As is | 114.9 g |
| P-892286087 | 95 | As is | unavailable |
| P-892213241 | 95 | As is | 982 mg |
| P-892309656 | 95 | As is | 980 mg |
| P-502331692 | 90 | As is | in stock |
| P-22502131 | 90 | As is | 180 mg |
| P-906905715 | 98 | As is | in stock |
| P-3238380 | 90 | As is | 274 mg |
| P-1271723183 | 95 | As is | in stock |
| P-1275218742 | 95 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 247.722 |
| logP | 2.6916 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 28.16 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 78.1117 |
| Atoms | 31 |
| Rings | 3 |
| Heavy atoms | 17 |
| Hydrogen atoms | 14 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| 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 |
