Hi everybody,
I'm making some computer simulations using DINACICLIB molecule, a kinase inhibitor.
link -> https://en.wikipedia.org/wiki/Dinaciclib
It's the Oxygen deprotonated at pH 7.5? I think yes. What do you think about it?
Maybe will be a stupid question but I must to be sure to use the correct protonation state.
Thanks to all!!!
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