| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 17th, 2008 | 25 | No |
Popular Name: (2S)-2-[4-(2-methylpropanoyl)piperazin-1-yl]-N-(2-nitrophenyl)propanamide (2S)-2-[4-(2-methylpropanoyl)pip…
| 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) | 1.72 | 6.09 | -14.38 | 1 | 8 | 0 | 98 | 348.403 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.72 | 8.26 | -50.18 | 2 | 8 | 1 | 100 | 349.411 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
