| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2008 | 19 | Yes |
Popular Name: (1R)-1-(4-isopropylphenyl)-2-(4-methylpiperazin-1-yl)ethanamine (1R)-1-(4-isopropylphenyl)-2-(4-…
| 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) | 0.86 | 6.7 | -101.98 | 4 | 3 | 2 | 35 | 263.429 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.86 | 3.96 | -1.97 | 2 | 3 | 0 | 32 | 261.413 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.86 | 5.91 | -33.75 | 3 | 3 | 1 | 34 | 262.421 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.86 | 4.24 | -43.78 | 3 | 3 | 1 | 34 | 262.421 | 4 | ↓ |
