| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 17th, 2010 | 18 | Yes |
Popular Name: 3-[5-[(4-ethylpiperazin-1-yl)methyl]-3-thienyl]prop-2-yn-1-ol 3-[5-[(4-ethylpiperazin-1-yl)met…
| 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) | 1.40 | 4.46 | -37.27 | 2 | 3 | 1 | 28 | 265.402 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.40 | 4.46 | -39.64 | 2 | 3 | 1 | 28 | 265.402 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.40 | 2.2 | -7.15 | 1 | 3 | 0 | 27 | 264.394 | 3 | ↓ |
