In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 18 | Yes |
Popular Name: 1-[5-(aminomethyl)-2-pyridyl]-N-methyl-piperidine-4-carboxamide 1-[5-(aminomethyl)-2-pyridyl]-N-…
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) | 0.21 | 2.55 | -53.15 | 4 | 5 | 1 | 73 | 249.338 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.21 | 2.15 | -13.11 | 3 | 5 | 0 | 71 | 248.33 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.21 | 2.87 | -109.47 | 5 | 5 | 2 | 74 | 250.346 | 3 | ↓ |