In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2010 | 15 | Yes |
Popular Name: (2R)-2,5,5-trimethyl-1-[[(2S)-tetrahydrofuran-2-yl]methyl]piperazine (2R)-2,5,5-trimethyl-1-[[(2S)-te…
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) | 1.50 | 3.5 | -32.39 | 2 | 3 | 1 | 29 | 213.345 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.50 | 5.35 | -100.57 | 3 | 3 | 2 | 30 | 214.353 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.50 | 4.14 | -26.71 | 2 | 3 | 1 | 26 | 213.345 | 2 | ↓ |