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| methanesulfonic acid; 4-[(4-methylpiperazin-1-yl)methyl]-N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]benzamide |
| methanesulfonic acid; 4-[(4-methylpiperazin-1-yl)methyl]-N-[4-methyl-3-[[4-(3-pyridyl)pyrimidin-2-yl]amino]phenyl]benzamide |
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Predict NMR spectrum
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| InChI: |
1S/C29H31N7O.CH4O3S/c1-21-5-10-25(18-27(21)34-29-31-13-11-26(33-29)24-4-3-12-30-19-24)32-28(37)23-8-6-22(7-9-23)20-36-16-14-35(2)15-17-36;1-5(2,3)4/h3-13,18-19H,14-17,20H2,1-2H3,(H,32,37)(H,31,33,34);1H3,(H,2,3,4) |
| InChIKey: |
YLMAHDNUQAMNNX-UHFFFAOYSA-N |
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| H donor: |
3 |
| H acceptor: |
11 |
| Rotatable bond: |
7 |
| Stereocenter: |
0 |
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| cLogP: |
2.051 |
| cLogS: |
-3.829 |
| Polar surface: |
149.03 |
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