| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 22nd, 2010 | 21 | Yes |
Popular Name: (1S,2S)-1-(4-ethylphenyl)-2-(4-isopropylpiperazin-1-yl)propan-1-ol (1S,2S)-1-(4-ethylphenyl)-2-(4-i…
| 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) | 2.97 | 7.08 | -33.28 | 2 | 3 | 1 | 28 | 291.459 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.97 | 4.86 | -3.05 | 1 | 3 | 0 | 27 | 290.451 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.97 | 6.61 | -32.17 | 2 | 3 | 1 | 28 | 291.459 | 5 | ↓ |
