| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2008 | 17 | Yes |
Popular Name: (2S)-2-(4-bromo-2-thienyl)-2-(4-methyl-1,4-diazepan-1-yl)ethanamine (2S)-2-(4-bromo-2-thienyl)-2-(4-…
| 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) | 1.53 | 4.65 | -110.03 | 4 | 3 | 2 | 35 | 320.3 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.53 | 2.2 | -48.99 | 3 | 3 | 1 | 34 | 319.292 | 3 | ↓ |
