| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2008 | 19 | No |
Popular Name: (4-methyl-1,4-diazepan-1-yl)-(3-nitrophenyl)methanone (4-methyl-1,4-diazepan-1-yl)-(3-…
| 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) | 1.00 | 8.24 | -48.58 | 1 | 6 | 1 | 71 | 264.305 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.00 | 6.22 | -14.58 | 0 | 6 | 0 | 69 | 263.297 | 2 | ↓ |
