Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6995009916-0
Structure
Show compound
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 | 13 USD | 97 | 9 working days | Get Quote |
| 5 mg | 13 USD | 97 | 9 working days | Get Quote |
| 10 mg | 13 USD | 97 | 9 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-5491591116-0
- Component type: Main
-
MCULE-1882009762-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-6995009916-0.sdf |
| SMILES | MCULE-6995009916-0.smiles |
| Standard InChI | MCULE-6995009916-0.inchi |
| InChIKey | MCULE-6995009916-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867597096 | N/A | As is | in stock |
| P-875756066 | N/A | As is | in stock |
| P-1275160634 | 95 | As is | in stock |
| P-903090749 | N/A | As is | 3 g |
| P-893606295 | 90 | As is | 4.13 g |
| P-866099682 | 95 | As is | 4 g |
| P-596993160 | N/A | As is | 3 g |
| P-1273456494 | 95 | As is | by resynthesis (? - ? days) |
| P-904969746 | 95 | As is | by synthesis |
| P-901519416 | 95 | As is | by synthesis |
| P-608496789 | 95 | As is | in stock |
| P-862032707 | 98 | As is | 3 g |
| P-855919249 | 97 | As is | 100 mg |
| P-588253967 | N/A | As is | by synthesis |
| P-852467902 | 95 | As is | by synthesis |
| P-895183130 | 95 | As is | in stock |
| P-896628408 | 95 | As is | by synthesis |
| P-584619815 | 95 | As is | in stock |
| P-878643186 | 98 | As is | in stock |
| P-892290859 | 95 | As is | unavailable |
| P-892228185 | 95 | As is | 100 mg |
| P-892321613 | 95 | As is | 100 mg |
| P-906783340 | 98 | As is | by synthesis |
| P-615642089 | 95 | As is | unavailable |
| P-615418628 | 95 | As is | in stock |
| P-1275182882 | 95 | As a main component | in stock |
| P-1275179656 | 98 | As a main component | in stock |
| P-1275181199 | 98 | As a main component | in stock |
| P-893618273 | 90 | As a main component | 842.148 g |
| P-580240918 | 95 | As a main component | by synthesis |
| P-489143128 | 97 | As a main component | in stock |
| P-1273291258 | 95 | As a main component | by resynthesis (? - ? days) |
| P-1273283290 | 95 | As a main component | by resynthesis (? - ? days) |
| P-864140513 | 95 | As a main component | in stock |
| P-901459202 | 95 | As a main component | by synthesis |
| P-617323116 | 90 | As a main component | in stock |
| P-851250713 | 95 | As a main component | by synthesis |
| P-870585785 | 97 | As a main component | in stock |
| P-870663116 | 98 | As a main component | in stock |
| P-870662149 | 98 | As a main component | in stock |
| P-868078261 | 95 | As a main component | in stock |
| P-524440212 | 97 | As a main component | 5.003 g |
| P-852459389 | 95 | As a main component | by synthesis |
| P-854717187 | 95 | As a main component | in stock |
| P-896627408 | 95 | As a main component | by synthesis |
| P-474024020 | 95 | As a main component | in stock |
| P-608274177 | 98 | As a main component | in stock |
| P-500409837 | 98 | As a main component | by synthesis |
| P-675098094 | 90 | As a main component | in stock |
| P-579711548 | 98 | As a main component | in stock |
| P-869127035 | 95 | As a main component | 1.005 g |
| P-892291240 | 95 | As a main component | 1.005 g |
| P-888640231 | 95 | As a main component | 1.005 g |
| P-873214996 | 90 | As a main component | in stock |
| P-906766304 | 99 | As a main component | by synthesis |
| P-617781089 | 90 | As a main component | 18.817 g |
| P-617729236 | 90 | As a main component | 18.817 g |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 374.902 |
| logP | 2.9317 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 8 |
| PSA | 35.94 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 113.1158 |
| Atoms | 53 |
| Rings | 3 |
| Heavy atoms | 26 |
| Hydrogen atoms | 27 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| 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 |
