| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2009 | 19 | Yes |
Popular Name: (1S)-2-(4-isopropylpiperazin-1-yl)-1-(o-tolyl)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) | 0.42 | 6.23 | -100.45 | 4 | 3 | 2 | 35 | 263.429 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.42 | 4.01 | -41.47 | 3 | 3 | 1 | 34 | 262.421 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.42 | 3.39 | -2.47 | 2 | 3 | 0 | 32 | 261.413 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.42 | 5.55 | -33.05 | 3 | 3 | 1 | 34 | 262.421 | 4 | ↓ |
