In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 17th, 2010 | 15 | Yes |
Popular Name: (2S)-2-amino-3-[ethyl-[[(2R)-tetrahydrofuran-2-yl]methyl]amino]propanoic (2S)-2-amino-3-[ethyl-[[(2R)-tet…
None
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) | -2.25 | 3.31 | -43.08 | 3 | 5 | 0 | 80 | 216.281 | 6 | ↓ |
Hi High (pH 8-9.5) | -2.25 | 0.93 | -42.88 | 2 | 5 | -1 | 79 | 215.273 | 6 | ↓ |
Mid Mid (pH 6-8) | -2.25 | 1.67 | -32.7 | 3 | 5 | 0 | 80 | 216.281 | 6 | ↓ |
Mid Mid (pH 6-8) | -2.25 | 3.65 | -78.95 | 4 | 5 | 1 | 81 | 217.289 | 6 | ↓ |