In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2011 | 21 | Yes |
Popular Name: [2-(4,4-diethyl-1-piperidyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl]methanamine [2-(4,4-diethyl-1-piperidyl)-6,7…
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) | 3.38 | 8.48 | -102.2 | 4 | 3 | 2 | 45 | 289.467 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.38 | 8.06 | -49.11 | 3 | 3 | 1 | 44 | 288.459 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.38 | 8.05 | -22.74 | 3 | 3 | 1 | 43 | 288.459 | 4 | ↓ |