In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 21 | Yes |
Popular Name: 2-[1-[3-(aminomethyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl]-4-piperidyl]acetamide 2-[1-[3-(aminomethyl)-6,7-dihydr…
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) | 1.11 | 4.01 | -102.29 | 6 | 5 | 2 | 88 | 290.411 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.11 | 3.59 | -50.61 | 5 | 5 | 1 | 87 | 289.403 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.11 | 3.6 | -28.15 | 5 | 5 | 1 | 86 | 289.403 | 4 | ↓ |