In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 16th, 2010 | 18 | Yes |
Popular Name: 2-[(3S)-3-(aminomethyl)-1-piperidyl]-6-methyl-pyridine-3-carboxamide 2-[(3S)-3-(aminomethyl)-1-piperi…
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) | -0.46 | 2.22 | -47.11 | 5 | 5 | 1 | 87 | 249.338 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.46 | 2.64 | -91.51 | 6 | 5 | 2 | 88 | 250.346 | 3 | ↓ |