| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2009 | 17 | Yes |
Popular Name: (2S)-2-[4-(2-aminoethyl)-1,4-diazepan-1-yl]-N-ethyl-propanamide (2S)-2-[4-(2-aminoethyl)-1,4-dia…
| 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) | -0.88 | 0.93 | -90.89 | 5 | 5 | 2 | 64 | 244.383 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.88 | 0.54 | -33.4 | 4 | 5 | 1 | 63 | 243.375 | 5 | ↓ |
