In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 16 | Yes |
Popular Name: 2-[4-[[(2S)-tetrahydropyran-2-yl]methyl]piperazin-1-yl]ethanamine 2-[4-[[(2S)-tetrahydropyran-2-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) | -0.08 | 2.13 | -91.29 | 4 | 4 | 2 | 45 | 229.368 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.08 | -0.12 | -43.36 | 3 | 4 | 1 | 43 | 228.36 | 4 | ↓ |