In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 14 | Yes |
Popular Name: 1-(1H-pyrazol-3-yl)-N-[[(2S)-tetrahydropyran-2-yl]methyl]methanamine 1-(1H-pyrazol-3-yl)-N-[[(2S)-tet…
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) | 1.00 | 2.82 | -37.52 | 3 | 4 | 1 | 55 | 196.274 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.00 | 1.39 | -7.83 | 2 | 4 | 0 | 50 | 195.266 | 4 | ↓ |