| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2010 | 21 | Yes |
Popular Name: (1S)-2-(4-isopropylpiperazin-1-yl)-1-(3-methoxyphenyl)-N-methyl-ethanamine (1S)-2-(4-isopropylpiperazin-1-y…
| 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) | 2.31 | 6.95 | -95.15 | 3 | 4 | 2 | 34 | 293.455 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.31 | 4.74 | -37.49 | 2 | 4 | 1 | 32 | 292.447 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.31 | 2.53 | -3.66 | 1 | 4 | 0 | 28 | 291.439 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.31 | 5.03 | -33.8 | 2 | 4 | 1 | 29 | 292.447 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.31 | 6.49 | -123.33 | 3 | 4 | 2 | 34 | 293.455 | 6 | ↓ |
