| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 16th, 2011 | 26 | Yes |
Popular Name: 2-isopropylsulfanyl-N-[1-(4-pyridylmethyl)-4-piperidyl]pyridine-3-carboxamide 2-isopropylsulfanyl-N-[1-(4-pyri…
| 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) | 2.05 | 9.25 | -51.71 | 2 | 5 | 1 | 59 | 371.53 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.05 | 6.99 | -12.35 | 1 | 5 | 0 | 58 | 370.522 | 6 | ↓ |
