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Predict NMR spectrum
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| InChI: |
1S/C33H37FN2O5.Na/c1-21(2)31-30(33(41)35-25-11-7-4-8-12-25)29(22-9-5-3-6-10-22)32(23-13-15-24(34)16-14-23)36(31)18-17-26(37)19-27(38)20-28(39)40;/h3-16,21,26-27,30-31,37-38H,17-20H2,1-2H3,(H,35,41)(H,39,40);/q;+1/p-1/t26-,27+,30?,31?;/m0./s1 |
| InChIKey: |
XUHVKQDGMHEIFL-KCEGUNEJSA-M |
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| H donor: |
3 |
| H acceptor: |
7 |
| Rotatable bond: |
12 |
| Stereocenter: |
4 |
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| cLogP: |
4.531 |
| cLogS: |
-5.342 |
| Polar surface: |
112.93 |
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