In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2011 | 21 | Yes |
Popular Name: 2-(4-ethyl-4-methyl-1-piperidyl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamidine 2-(4-ethyl-4-methyl-1-piperidyl)…
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) | 2.25 | 7.28 | -35.15 | 4 | 4 | 1 | 68 | 287.431 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.25 | 8.31 | -6.4 | 3 | 4 | 0 | 66 | 286.423 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.25 | 7.7 | -89.04 | 5 | 4 | 2 | 69 | 288.439 | 3 | ↓ |