In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 19 | Yes |
Popular Name: (1R)-N-[[(2S)-tetrahydropyran-2-yl]methyl]-1-(2,4,6-trimethyl-3-pyridyl)ethanamine (1R)-N-[[(2S)-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 | 7.02 | -38.22 | 2 | 3 | 1 | 39 | 263.405 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.90 | 6.61 | -6.77 | 1 | 3 | 0 | 34 | 262.397 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.90 | 7.4 | -91.6 | 3 | 3 | 2 | 40 | 264.413 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.90 | 6.99 | -23.01 | 2 | 3 | 1 | 35 | 263.405 | 4 | ↓ |