Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6770545200
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 | 98 | 14 working days | Get Quote |
| 5 mg | 5 USD | 98 | 14 working days | Get Quote |
| 10 mg | 5 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-6770545200.sdf |
| SMILES | MCULE-6770545200.smiles |
| Standard InChI | MCULE-6770545200.inchi |
| InChIKey | MCULE-6770545200.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867585781 | 97 | As is | in stock |
| P-875744340 | 97 | As is | in stock |
| P-1275147850 | 95 | As is | in stock |
| P-1275166583 | 98 | As is | in stock |
| P-872728459 | 98 | As is | in stock |
| P-903075039 | 98 | As is | 1000 g |
| P-606908566 | N/A | As is | in stock |
| P-596954232 | 97 | As is | 1000 g |
| P-1273455220 | 95 | As is | by resynthesis (? - ? days) |
| P-866730031 | 95 | As is | 1.995 g |
| P-596508510 | 90 | As is | 34 mg |
| P-870025113 | 90 | As is | 34 mg |
| P-864125205 | 95 | As is | in stock |
| P-4164536 | 90 | As is | 100 mg |
| P-619325727 | 90 | As is | 140 mg |
| P-425210948 | 90 | As is | in stock |
| P-868612820 | 98 | As is | in stock |
| P-34802115 | 90 | As is | by synthesis |
| P-580301038 | 95 | As is | by resynthesis (? - ? days) |
| P-594269253 | 90 | As is | in stock |
| P-579803077 | 90 | As is | in stock |
| P-905350021 | 95 | As is | 590 g |
| P-862056910 | 95 | As is | 1.82766 kg |
| P-870660941 | N/A | As is | in stock |
| P-502468499 | 95 | As is | by synthesis |
| P-580006463 | 95 | As is | in stock |
| P-502763878 | 90 | As is | in stock |
| P-488543269 | 90 | As is | in stock |
| P-13586371 | 92 | As is | 300 mg |
| P-856009949 | 95 | As is | 100 mg |
| P-31152228 | 90 | As is | unavailable |
| P-1267083882 | 95 | As is | 250 mg |
| P-467964043 | 95 | As is | 378 mg |
| P-14074784 | 90 | As is | 378 mg |
| P-588252978 | N/A | As is | by synthesis |
| P-852396329 | N/A | As is | by synthesis |
| P-1272569292 | N/A | As is | in stock |
| P-35165522 | 90 | As is | in stock |
| P-863734685 | 95 | As is | in stock |
| P-608279883 | 98 | As is | in stock |
| P-454363897 | 92 | As is | in stock |
| P-864658614 | 92 | As is | 300 mg |
| P-856063859 | 95 | As is | in stock |
| P-19219395 | 90 | As is | in stock |
| P-617404882 | 98 | As is | in stock |
| P-896074568 | N/A | As is | 1.24 g |
| P-580052693 | 95 | As is | 1.201 g |
| P-892300919 | 95 | As is | 1.201 g |
| P-888660051 | 95 | As is | 1.201 g |
| P-502338189 | 90 | As is | in stock |
| P-903644191 | 94 | As is | by resynthesis (? - ? days) |
| P-25051921 | 90 | As is | 2.694 g |
| P-3221583 | 90 | As is | 2.694 g |
| P-1271635075 | 97 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 190.151 |
| logP | 1.4912 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 67.51 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 49.4433 |
| Atoms | 20 |
| Rings | 2 |
| Heavy atoms | 14 |
| Hydrogen atoms | 6 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| 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 |
