Molecule ID: mol17435

SMILES: O=C1/C(=C/c2ccccc2)CN(C(=O)c2ccc(OCCN3CCCCC3)cc2)C/C1=C\c1ccccc1

InChI: InChI=1S/C33H34N2O3/c36-32-29(22-26-10-4-1-5-11-26)24-35(25-30(32)23-27-12-6-2-7-13-27)33(37)28-14-16-31(17-15-28)38-21-20-34-18-8-3-9-19-34/h1-2,4-7,10-17,22-23H,3,8-9,18-21,24-25H2/b29-22+,30-23+

Experimental Macro pKa Values

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