In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 9th, 2011 | 25 | Yes |
Popular Name: N-hexyl-2-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)-1-piperidyl]acetamide N-hexyl-2-[4-([1,2,4]triazolo[4,…
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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) | 3.33 | 10.7 | -54.98 | 2 | 6 | 1 | 64 | 344.483 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.33 | 8.52 | -21.43 | 1 | 6 | 0 | 63 | 343.475 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.