| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 26th, 2011 | 24 | No |
Popular Name: (3S)-N-ethyl-1-[2-(2-nitroanilino)-2-oxo-ethyl]piperidine-3-carboxamide (3S)-N-ethyl-1-[2-(2-nitroanilin…
| 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) | 1.68 | 6.75 | -44.57 | 3 | 8 | 1 | 108 | 335.384 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.68 | 4.57 | -12.22 | 2 | 8 | 0 | 107 | 334.376 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.50 | 6.2 | -31.71 | 2 | 8 | 0 | 115 | 334.376 | 6 | ↓ |
