In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 12th, 2008 | 28 | No |
Popular Name: DehydroDonepezil(DonepezilImpurity) DehydroDonepezil(DonepezilImpurity)
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CAS Number: 120014-07-5
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 3.73 | 12.71 | -46.1 | 1 | 4 | 1 | 40 | 378.492 | 5 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
ACES-10-E | Acetylcholinesterase (cluster #10 Of 12), Eukaryotic | Eukaryotes | 13 | 0.39 | Binding ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
ACES_MOUSE | P21836 | Acetylcholinesterase, Mouse | 13 | 0.39 | Binding ≤ 1μM |
ACES_MOUSE | P21836 | Acetylcholinesterase, Mouse | 13 | 0.39 | Binding ≤ 10μM |
Description | Species |
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Neurotransmitter Clearance In The Synaptic Cleft | |
Synthesis of PC |