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MCULE-4013673344-0
Structure
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- 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 | 50 USD | 95 | 12 working days | Get Quote |
| 5 mg | 118 USD | 95 | 12 working days | Get Quote |
| 10 mg | 181 USD | 95 | 12 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-4013673344-0.sdf |
| SMILES | MCULE-4013673344-0.smiles |
| Standard InChI | MCULE-4013673344-0.inchi |
| InChIKey | MCULE-4013673344-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-864277127 | 95 | As is | by synthesis |
| P-864182384 | 95 | As is | in stock |
| P-887183865 | 95 | As is | by synthesis |
| P-868078387 | 95 | As is | in stock |
| P-854717022 | 95 | As is | in stock |
| P-871070311 | 95 | As is | in stock |
| P-904245843 | 95 | As is | unavailable |
| P-869119469 | 95 | As is | 61 mg |
| P-888634388 | 95 | As is | 58 mg |
| P-1271629735 | 97 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 617.182 |
| logP | 6.3146 |
| H-bond acceptors | 10 |
| H-bond donors | 2 |
| Rotatable bonds | 8 |
| PSA | 96.94 |
| RO5 violations | 2 |
| RO3 violations | 5 |
| Refractivity | 189.5944 |
| Atoms | 85 |
| Rings | 6 |
| Heavy atoms | 44 |
| Hydrogen atoms | 41 |
| Heteroatoms | 11 |
| N/O atoms | 10 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 2 |
| R/S chiral centers | 2 |
| 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 |
