| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 17 | Yes |
Popular Name: (2S)-2-amino-1-[4-(2-methoxyethyl)-1,4-diazepan-1-yl]butan-1-one (2S)-2-amino-1-[4-(2-methoxyethy…
| 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) | -0.45 | 3.26 | -91.28 | 4 | 5 | 2 | 62 | 245.367 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.45 | 2.94 | -36.79 | 3 | 5 | 1 | 60 | 244.359 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.45 | 1.02 | -6.64 | 2 | 5 | 0 | 59 | 243.351 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.45 | 1.34 | -42.48 | 3 | 5 | 1 | 60 | 244.359 | 5 | ↓ |
