In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 13 | Yes |
Popular Name: (3S)-1-[[(2S)-tetrahydrofuran-2-yl]methyl]piperidin-3-amine (3S)-1-[[(2S)-tetrahydrofuran-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) | -0.02 | 0.57 | -44.46 | 3 | 3 | 1 | 40 | 185.291 | 2 | ↓ |
Mid Mid (pH 6-8) | -0.02 | 2.64 | -31.28 | 3 | 3 | 1 | 40 | 185.291 | 2 | ↓ |
Mid Mid (pH 6-8) | -0.02 | 2.96 | -107.58 | 4 | 3 | 2 | 41 | 186.299 | 2 | ↓ |