| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 21st, 2009 | 20 | No |
Popular Name: 2-[3-(4-methylpiperazin-1-yl)propoxy]benzenecarbothioamide 2-[3-(4-methylpiperazin-1-yl)pro…
| 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) | 1.94 | 5.82 | -41.37 | 3 | 4 | 1 | 43 | 294.444 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.94 | 3.45 | -14.25 | 2 | 4 | 0 | 42 | 293.436 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.94 | 5.71 | -40.32 | 3 | 4 | 1 | 43 | 294.444 | 6 | ↓ |
