| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 21st, 2009 | 21 | No |
Popular Name: 3-[(2S)-2-hydroxy-3-(4-methylpiperazin-1-yl)propoxy]benzenecarbothioamide 3-[(2S)-2-hydroxy-3-(4-methylpip…
| 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) | 1.05 | 2.47 | -48.89 | 4 | 5 | 1 | 63 | 310.443 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.05 | 0.09 | -18.42 | 3 | 5 | 0 | 62 | 309.435 | 6 | ↓ |
