| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2009 | 21 | Yes |
Popular Name: 3-[(4-ethylpiperazin-1-yl)methyl]benzothiophene-2-carboxylic 3-[(4-ethylpiperazin-1-yl)methyl…
| 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) | 2.72 | 8.12 | -41.37 | 1 | 4 | 0 | 48 | 304.415 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.72 | 5.85 | -52.01 | 0 | 4 | -1 | 47 | 303.407 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.72 | 8.11 | -52.9 | 1 | 4 | 0 | 48 | 304.415 | 4 | ↓ |
