| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 16th, 2009 | 27 | No |
Popular Name: N-[(2S)-2-(diethylamino)propyl]-2-[(oxoBLAHyl)methylsulfanyl]acetamide N-[(2S)-2-(diethylamino)propyl]-…
| 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) | 2.22 | 8.54 | -53.94 | 3 | 6 | 1 | 79 | 409.601 | 9 | ↓ |
| Hi High (pH 8-9.5) | 2.68 | 6.09 | -79.27 | 2 | 6 | 0 | 82 | 408.593 | 9 | ↓ |
| Hi High (pH 8-9.5) | 2.22 | 6.13 | -23.01 | 2 | 6 | 0 | 78 | 408.593 | 9 | ↓ |
