In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 3rd, 2010 | 14 | Yes |
Popular Name: (2S)-2-methyl-1-[[(2S)-tetrahydropyran-2-yl]methyl]piperazine (2S)-2-methyl-1-[[(2S)-tetrahydr…
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) | 0.85 | 2.34 | -37.85 | 2 | 3 | 1 | 29 | 199.318 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.85 | 1 | -2.5 | 1 | 3 | 0 | 24 | 198.31 | 2 | ↓ |