| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 29th, 2011 | 21 | No |
Popular Name: 2-[(2S)-2-isopropyl-3-oxo-piperazin-1-yl]-N-methyl-N-(2-thienylmethyl)acetamide 2-[(2S)-2-isopropyl-3-oxo-pipera…
| 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) | 1.07 | 4.21 | -12.24 | 1 | 5 | 0 | 53 | 309.435 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.07 | 5.93 | -43.4 | 2 | 5 | 1 | 54 | 310.443 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
