| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 21st, 2009 | 19 | No |
Popular Name: N-(3-amino-3-thioxo-propyl)-N-methyl-2-(4-propylpiperazin-1-yl)acetamide N-(3-amino-3-thioxo-propyl)-N-me…
| 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) | -0.35 | 4.14 | -42.62 | 3 | 5 | 1 | 54 | 287.453 | 7 | ↓ |
| Mid Mid (pH 6-8) | -0.35 | 4.06 | -44.9 | 3 | 5 | 1 | 54 | 287.453 | 7 | ↓ |
| Mid Mid (pH 6-8) | -0.35 | 1.86 | -13.91 | 2 | 5 | 0 | 53 | 286.445 | 7 | ↓ |
