| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2009 | 20 | Yes |
Popular Name: [4-(4-methyl-1,4-diazepan-1-yl)-2-(trifluoromethyl)phenyl]methanamine [4-(4-methyl-1,4-diazepan-1-yl)-…
| 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) | 2.21 | 6.84 | -90.33 | 4 | 3 | 2 | 35 | 289.345 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.21 | 6.6 | -38.69 | 3 | 3 | 1 | 34 | 288.337 | 3 | ↓ |
