| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2009 | 16 | Yes |
Popular Name: (2S)-2-[4-(2-aminoethyl)-1,4-diazepan-1-yl]-N-methyl-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) | -1.25 | 0.09 | -91.15 | 5 | 5 | 2 | 64 | 230.356 | 4 | ↓ |
| Hi High (pH 8-9.5) | -1.25 | -0.3 | -34.11 | 4 | 5 | 1 | 63 | 229.348 | 4 | ↓ |
