| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2009 | 18 | Yes |
Popular Name: (2S)-2-methyl-3-[4-[[(2R)-tetrahydropyran-2-yl]methyl]piperazin-1-yl]propan-1-amine (2S)-2-methyl-3-[4-[[(2R)-tetrah…
| 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) | 0.66 | 3.9 | -87.77 | 4 | 4 | 2 | 45 | 257.422 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.66 | 1.6 | -43.44 | 3 | 4 | 1 | 43 | 256.414 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.66 | 3.58 | -103.35 | 4 | 4 | 2 | 45 | 257.422 | 5 | ↓ |
