| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 24th, 2008 | 21 | Yes |
Popular Name: (1S)-1-(4-tert-butylphenyl)-2-(4-ethylpiperazin-1-yl)ethanamine (1S)-1-(4-tert-butylphenyl)-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) | 1.43 | 7.84 | -101.54 | 4 | 3 | 2 | 35 | 291.483 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.43 | 5.53 | -43.41 | 3 | 3 | 1 | 34 | 290.475 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.43 | 5.25 | -1.7 | 2 | 3 | 0 | 32 | 289.467 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.43 | 7.16 | -33.81 | 3 | 3 | 1 | 34 | 290.475 | 5 | ↓ |
