| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 13th, 2011 | 23 | Yes |
Popular Name: (3S,4S)-4-(4-methylpiperazin-1-yl)-1-(2,2,6,6-tetramethyl-4-piperidyl)pyrrolidin-3-ol (3S,4S)-4-(4-methylpiperazin-1-y…
| 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) | 1.26 | 1.39 | -78.97 | 4 | 5 | 2 | 48 | 326.529 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.26 | -0.98 | -34.91 | 3 | 5 | 1 | 47 | 325.521 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.26 | 3.86 | -166.59 | 5 | 5 | 3 | 49 | 327.537 | 2 | ↓ |
