| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 19 | Yes |
Popular Name: 1-(1,4-diazepan-1-yl)-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]ethanone 1-(1,4-diazepan-1-yl)-2-[methyl-…
| 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) | -0.96 | 5.42 | -103.04 | 3 | 6 | 2 | 59 | 267.377 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.96 | 3.16 | -50.53 | 2 | 6 | 1 | 58 | 266.369 | 4 | ↓ |
