Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3470170095
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 | 95 | 14 working days | Get Quote |
| 5 mg | 5 USD | 95 | 14 working days | Get Quote |
| 10 mg | 5 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.
-
1
MCULE-5742121668
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-3470170095.sdf |
| SMILES | MCULE-3470170095.smiles |
| Standard InChI | MCULE-3470170095.inchi |
| InChIKey | MCULE-3470170095.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-563657236 | 95 | As is | 250 mg |
| P-852487824 | N/A | As is | by synthesis |
| P-867661544 | 96 | Main component | in stock |
| P-875830280 | 96 | Main component | in stock |
| P-890256760 | 97 | Main component | by synthesis |
| P-1275189159 | 95 | Main component | in stock |
| P-903206010 | 95 | Main component | 50 g |
| P-893513636 | 90 | Main component | 1.1138 kg |
| P-1270389001 | 97 | Main component | in stock |
| P-580237954 | 95 | Main component | by synthesis |
| P-606928230 | N/A | Main component | in stock |
| P-489147883 | 97 | Main component | in stock |
| P-596972697 | 95 | Main component | 38.799 g |
| P-494347964 | 95 | Main component | 2.075 g |
| P-864092387 | 95 | Main component | in stock |
| P-580728133 | 97 | Main component | 9 g |
| P-893234797 | 95 | Main component | in stock |
| P-619926712 | 90 | Main component | by synthesis |
| P-851265249 | 95 | Main component | by synthesis |
| P-851287368 | 95 | Main component | by synthesis |
| P-861277894 | 95 | Main component | in stock |
| P-868578895 | 97 | Main component | in stock |
| P-580417180 | 95 | Main component | by resynthesis (? - ? days) |
| P-575337152 | 95 | Main component | in stock |
| P-861986070 | 95 | Main component | 50 g |
| P-889114200 | 95 | Main component | 1000 mg |
| P-870661059 | N/A | Main component | in stock |
| P-890215198 | 90 | Main component | in stock |
| P-590337631 | 90 | Main component | 5 g |
| P-505491181 | 95 | Main component | in stock |
| P-14042448 | 90 | Main component | no data |
| P-890850757 | 90 | Main component | in stock |
| P-563559336 | 95 | Main component | 1000 mg |
| P-524186594 | 95 | Main component | 170 mg |
| P-18813935 | 90 | Main component | 886 mg |
| P-579620342 | 95 | Main component | in stock |
| P-580514714 | 95 | Main component | in stock |
| P-852381754 | 95 | Main component | by synthesis |
| P-899992668 | 95 | Main component | in stock |
| P-902985067 | 95 | Main component | by synthesis |
| P-881187092 | 90 | Main component | 50 mg |
| P-500399952 | 99 | Main component | by synthesis |
| P-856070039 | 95 | Main component | in stock |
| P-23187593 | 94 | Main component | by resynthesis (? - ? days) |
| P-906775027 | 98 | Main component | by synthesis |
| P-906783021 | 98 | Main component | by synthesis |
| P-854990214 | 90 | Main component | in stock |
| P-854955503 | 90 | Main component | in stock |
| P-590436345 | 97 | Main component | in stock |
| P-904515532 | 95 | Main component as a main component | by resynthesis (? - ? days) |
| P-867737187 | N/A | Main component as a main component | by synthesis |
| P-864254443 | 95 | Main component as a main component | by synthesis |
| P-608394115 | 95 | Main component as a main component | by synthesis |
| P-675293520 | 95 | Main component as a main component | by synthesis |
| P-596584713 | 95 | Main component as a main component | 1000 mg |
| P-524190821 | 97 | Main component as a main component | 250 mg |
| P-524199539 | 95 | Main component as a main component | 250 mg |
| P-580510645 | 95 | Main component as a main component | in stock |
| P-1272566136 | 95 | Main component as a main component | 500 mg |
| P-852385830 | 95 | Main component as a main component | by synthesis |
| P-895537056 | 95 | Main component as a main component | by synthesis |
| P-854959030 | 90 | Main component as a main component | in stock |
| P-1271465488 | 95 | Main component as a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 184.664 |
| logP | 2.6369 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 24.92 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 55.1917 |
| Atoms | 25 |
| Rings | 2 |
| Heavy atoms | 12 |
| Hydrogen atoms | 13 |
| Heteroatoms | 3 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
