Molecule ID: mol16443

SMILES: O=C(CCN(CCO)CCO)Nc1ccc2c(c1)C(=O)c1ccc(NC(=O)CCN(CCO)CCO)cc1C2=O

InChI: InChI=1S/C28H36N4O8/c33-13-9-31(10-14-34)7-5-25(37)29-19-1-3-21-23(17-19)28(40)22-4-2-20(18-24(22)27(21)39)30-26(38)6-8-32(11-15-35)12-16-36/h1-4,17-18,33-36H,5-16H2,(H,29,37)(H,30,38)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
9.00 Baltruschat ChEMBL 1 » 0
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Charge States and Microspecies Visualization