Chem Formulas - Drift sourced

Formula

MW

Atoms

Complexity

Novelty

Neuro Score

Notes

N₁O₁Br₃Co₃C₃

385

11

5

17

34/35

N–O core; three Br ligands for electrophilic modulation; three Co centers for redox activity; C₃ scaffold for lipophilicity tuning.

N₁O₁Br₂Ca₂I₃

440

9

5

17

26/35

N–O core; dual Br–I halogenation enhances membrane permeability; Ca coordination stabilizes structure in aqueous environments.

N₁O₁P₃N₂Fe₂

567

9

5

8

25/35

N–O core; triphosphoryl tail mimics ATP moiety; dual Fe centers enable Fenton-like ROS modulation; di-N motif confers hydrogen bonding.

N₁O₁Cu₃Rb₁C₂

256

8

5

15

23/35

N–O core; tri-Cu cluster catalyzes oxidative transformations; Rb+ ion provides ionic mimic of K+ channels; C₂ linker supports rigidity.

N₁O₁Mg₃Zn₃

403

8

4

7

23/35

N–O core; mixed Mg/Zn coordination for metalloenzyme mimicry; small size and charge balance optimized for blood–brain barrier crossing.

N₁O₁Ca₁P₁

596

4

4

15

22/35

N–O core; single Ca and P centers form stable phosphate ester; high MW but potential prodrug for sustained release.

N₁O₁I₃H₃

214

8

4

19

21/35

N–O core; tri-Iodyl motif confers X-ray contrast potential; H₃ tail yields water solubility; compact emergency imaging agent.

N₁O₁K₃Br₂

405

7

4

11

21/35

N–O core; K⁺ mimicry suggests ion channel modulation; dual Br for reversible enzyme inhibition; lipophilicity tuned.

N₁O₁Fe₂Fe₂

288

6

4

13

18/35

N–O core; di-Fe–Fe bimetallic motif emulates diiron oxygenases; low MW for rapid diffusion; scaffold supports redox cycling.

N₁O₁Fe₃

232

5

3

8

18/35

N–O core; tri-Fe cluster for catalytic ROS generation; minimal complexity for facile synthesis.

N₁O₁K₁N₃

523

6

4

11

10/35

N–O core with K⁺-binding motif; triple N enhances H-bond network; moderate novelty.

N₁O₁H₁

260

3

3

5

10/35

Minimal N–O scaffold only; baseline neurochemical mimic; low complexity.