| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 19 | Yes |
Popular Name: 2-[4-[(1S,2R)-2-amino-1-(3-methyl-2-thienyl)propyl]piperazin-1-yl]ethanol 2-[4-[(1S,2R)-2-amino-1-(3-methy…
| 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) | 0.67 | -0.85 | -45.6 | 4 | 4 | 1 | 54 | 284.449 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.67 | -1.26 | -5.12 | 3 | 4 | 0 | 53 | 283.441 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.67 | 1.95 | -91.13 | 5 | 4 | 2 | 56 | 285.457 | 5 | ↓ |
