In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 11 | No |
Popular Name: 2-[[(2S)-tetrahydropyran-2-yl]methylamino]acetonitrile 2-[[(2S)-tetrahydropyran-2-yl]me…
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) | 0.41 | 1.77 | -6.68 | 1 | 3 | 0 | 45 | 154.213 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.41 | 3.15 | -49.96 | 2 | 3 | 1 | 50 | 155.221 | 3 | ↓ |