| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 20th, 2009 | 22 | Yes |
Popular Name: (2S)-2-[butyl(methyl)amino]-2-(3-hydroxyphenyl)-1-piperazin-1-yl-ethanone (2S)-2-[butyl(methyl)amino]-2-(3…
| 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) | 1.51 | 3.23 | -51.42 | 3 | 5 | 1 | 60 | 306.43 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.51 | 1.97 | -11.98 | 2 | 5 | 0 | 56 | 305.422 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.51 | 5.42 | -106.91 | 4 | 5 | 2 | 62 | 307.438 | 6 | ↓ |
