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Sudan III	Predict NMR spectrum	RN:  85-86-9 MF:  C22H16N4O MW:  352.39524
InChI:  1S/C22H16N4O/c27-21-15-10-16-6-4-5-9-20(16)22(21)26-25-19-13-11-18(12-14-19)24-23-17-7-2-1-3-8-17/h1-15,27H/b24-23+,26-25+ InChIKey:  FHNINJWBTRXEBC-QSZPNPOGSA-N	H donor:  1 H acceptor:  5 Rotatable bond:  4 Stereocenter:  0	cLogP:  7.576 cLogS:  -7.91 Polar surface:  69.67 NEW: 3D model:  Show
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