| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 11th, 2010 | 17 | Yes |
Popular Name: (3S,4S)-4-(4-ethylpiperazin-1-yl)-5,5-dimethyl-hexan-3-amine (3S,4S)-4-(4-ethylpiperazin-1-yl…
| 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) | 2.04 | 4.85 | -102.95 | 4 | 3 | 2 | 35 | 243.439 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.04 | 2.58 | -35.88 | 3 | 3 | 1 | 34 | 242.431 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.04 | 4.42 | -106.31 | 4 | 3 | 2 | 35 | 243.439 | 5 | ↓ |
