In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 19th, 2010 | 19 | Yes |
Popular Name: (2S)-3-(1H-imidazol-4-yl)-2-[[(2R)-morpholine-2-carbonyl]amino]propanoic (2S)-3-(1H-imidazol-4-yl)-2-[[(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) | -3.50 | 3.15 | -123.38 | 5 | 8 | 1 | 125 | 269.281 | 5 | ↓ |
Hi High (pH 8-9.5) | -3.50 | 1.18 | -65.81 | 3 | 8 | -1 | 119 | 267.265 | 5 | ↓ |
Mid Mid (pH 6-8) | -3.50 | 2.61 | -92.16 | 4 | 8 | 0 | 124 | 268.273 | 5 | ↓ |