| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 21st, 2009 | 18 | No |
Popular Name: N-(3-amino-3-thioxo-propyl)-2-(4-ethylpiperazin-1-yl)-N-methyl-acetamide N-(3-amino-3-thioxo-propyl)-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) | -0.85 | 3.4 | -42.03 | 3 | 5 | 1 | 54 | 273.426 | 6 | ↓ |
| Mid Mid (pH 6-8) | -0.85 | 3.31 | -44.73 | 3 | 5 | 1 | 54 | 273.426 | 6 | ↓ |
| Mid Mid (pH 6-8) | -0.85 | 1.11 | -14.08 | 2 | 5 | 0 | 53 | 272.418 | 6 | ↓ |
