In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 20 | Yes |
Popular Name: 2-(4-ethyl-1-piperidyl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamidine 2-(4-ethyl-1-piperidyl)-6,7-dihy…
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) | 2.19 | 7.14 | -34.75 | 4 | 4 | 1 | 68 | 273.404 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.19 | 8.18 | -6.57 | 3 | 4 | 0 | 66 | 272.396 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.19 | 7.58 | -87.87 | 5 | 4 | 2 | 69 | 274.412 | 3 | ↓ |