| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 8th, 2010 | 21 | Yes |
Popular Name: 1-(2-cyanoethyl)-N-(4-isopropylthiazol-2-yl)piperidine-4-carboxamide 1-(2-cyanoethyl)-N-(4-isopropylt…
| 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) | 1.71 | 7.83 | -59.7 | 2 | 5 | 1 | 70 | 307.443 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.64 | 4.97 | -12.18 | 1 | 5 | 0 | 72 | 306.435 | 4 | ↓ |
