| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 21st, 2009 | 17 | No |
Popular Name: N-(3-amino-3-thioxo-propyl)-N-methyl-2-(4-methylpiperazin-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) | -1.23 | 2.72 | -43.53 | 3 | 5 | 1 | 54 | 259.399 | 5 | ↓ |
| Mid Mid (pH 6-8) | -1.23 | 2.52 | -44.67 | 3 | 5 | 1 | 54 | 259.399 | 5 | ↓ |
| Mid Mid (pH 6-8) | -1.23 | 0.33 | -14.28 | 2 | 5 | 0 | 53 | 258.391 | 5 | ↓ |
