In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2008 | 24 | No |
Popular Name: (3R)-3-(1-oxo-4-phenyl-2,4,8-triazaspiro[4.5]decan-8-yl)pyrrolidine-2,5-dione (3R)-3-(1-oxo-4-phenyl-2,4,8-tri…
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) | 0.03 | 0.49 | -13.3 | 2 | 7 | 0 | 82 | 328.372 | 2 | ↓ |
Ref Reference (pH 7) | 0.03 | 0.44 | -13.24 | 2 | 7 | 0 | 82 | 328.372 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.22 | -2.07 | -50.89 | 1 | 7 | -1 | 88 | 327.364 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.22 | -2.08 | -50.96 | 1 | 7 | -1 | 88 | 327.364 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.03 | 2.92 | -45.61 | 3 | 7 | 1 | 83 | 329.38 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.22 | 0.37 | -37.54 | 2 | 7 | 0 | 89 | 328.372 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.22 | 0.37 | -37.6 | 2 | 7 | 0 | 89 | 328.372 | 2 | ↓ |