 This anaesthetic has more than one structural configuration. An example low energy conformer is shown. Surface View:
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Surface view shows the electrostatic potential of the conformer mapped onto
the solvent excluded surface, based on a probe of radius 1.4Å.
Regions of negative potential are shown in red, positive in blue.
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| In Vivo Activity Data | ||
| Immobility: MAC Rat (atm) | 0.057 ± 0.006 (n=16) | DiFazio CA, Brown RE, Ball CG, et al. Anesthesiology 1972; 36: 57-63 |
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| Physical Properties | ||
| Olive Oil / Gas Partition Coeff. at 37°C | 29 ± 0.8 (n=8) | Edelist G, Singer MM, Eger EI II. Anesthesiology 1964; 25:223-5 |
| Blood / Gas Partition Coeff. at 37°C | 0.6 ± 0.05 (n=7) | Edelist G, Singer MM, Eger EI II. Anesthesiology 1964; 25:223-5 |
| Water / Gas Partition Coeff. at 37°C | 0.32 ± 0.03 (n=13) | Edelist G, Singer MM, Eger EI II. Anesthesiology 1964; 25:223-5 |
| Calculated Molecular Properties | ||
| van der Waals Volume | 82 Å3 | |
| van der Waals Surface Area | 118 Å2 | |
| Solvent Accessible Volume | 332 Å3 | (based on a 1.4Å probe) |
| Solvent Accessible Surface Area | 246 Å2 | (based on a 1.4Å probe) |
All values are mean ± SD, except
data labelled with † which are mean ± SEM.
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Database Version: 1.09.9 Last Updated: 21st February 2014
Database Version: 1.09.9 Last Updated: 21st February 2014