| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2008 | 14 | No |
Popular Name: [(3S)-3-(4-methylpiperazin-1-yl)tetrahydrothiophen-3-yl]methanamine [(3S)-3-(4-methylpiperazin-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) | -0.25 | 2.67 | -105.65 | 4 | 3 | 2 | 35 | 217.382 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.25 | 0.21 | -47.92 | 3 | 3 | 1 | 34 | 216.374 | 2 | ↓ |
