| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 24th, 2008 | 20 | Yes |
Popular Name: (1S)-2-(4-ethylpiperazin-1-yl)-1-(2-methoxy-5-methyl-phenyl)ethanamine (1S)-2-(4-ethylpiperazin-1-yl)-1…
| 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) | 0.16 | 5.06 | -100.65 | 4 | 4 | 2 | 45 | 279.428 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.16 | 2.67 | -43.14 | 3 | 4 | 1 | 43 | 278.42 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.16 | 2.43 | -3.69 | 2 | 4 | 0 | 42 | 277.412 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.16 | 4.59 | -32.25 | 3 | 4 | 1 | 43 | 278.42 | 5 | ↓ |
