In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2004 | 21 | Yes |
Popular Name: 2-(azocan-1-ium-1-yl)-N-(2,6-dichloro-3-methyl-phenyl)acetamide 2-(azocan-1-ium-1-yl)-N-(2,6-dic…
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) | 5.09 | 9.97 | -36.3 | 2 | 3 | 1 | 34 | 330.279 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.91 | 9.01 | -28.09 | 1 | 3 | 0 | 40 | 329.271 | 3 | ↓ |