| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 14th, 2010 | 19 | Yes |
Popular Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-4-methyl-1,4-diazepane 1-[3-chloro-5-(trifluoromethyl)-…
| 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) | 2.81 | 8.81 | -34.92 | 1 | 3 | 1 | 21 | 294.728 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.81 | 6.8 | -2.55 | 0 | 3 | 0 | 19 | 293.72 | 2 | ↓ |
