In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 19 | Yes |
Popular Name: (1S)-N-[[(2R)-tetrahydropyran-2-yl]methyl]-1-(2,4,6-trimethyl-3-pyridyl)ethanamine (1S)-N-[[(2R)-tetrahydropyran-2-…
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) | 2.90 | 7.03 | -39.46 | 2 | 3 | 1 | 39 | 263.405 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.90 | 6.46 | -4.33 | 1 | 3 | 0 | 34 | 262.397 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.90 | 7.41 | -89.52 | 3 | 3 | 2 | 40 | 264.413 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.90 | 6.85 | -24.92 | 2 | 3 | 1 | 35 | 263.405 | 4 | ↓ |