In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 28th, 2011 | 21 | No |
Popular Name: (2S)-2-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]nonan-1-amine (2S)-2-[4-(2,2,2-trifluoroethyl)…
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) | 3.41 | 4.53 | -46 | 3 | 3 | 1 | 34 | 310.428 | 10 | ↓ |
Lo Low (pH 4.5-6) | 3.41 | 6.34 | -129.55 | 4 | 3 | 2 | 35 | 311.436 | 10 | ↓ |