| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2009 | 21 | Yes |
Popular Name: [4-[(2S)-3-amino-2-methyl-propyl]-1,4-diazepan-1-yl]-(4-fluorophenyl)methanone [4-[(2S)-3-amino-2-methyl-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) | 0.78 | 7.03 | -111.41 | 4 | 4 | 2 | 52 | 295.402 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.78 | 6.65 | -41.32 | 3 | 4 | 1 | 51 | 294.394 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.78 | 5.49 | -47.92 | 3 | 4 | 1 | 51 | 294.394 | 4 | ↓ |
