| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 25th, 2010 | 16 | No |
Popular Name: (3R)-3-[(4-isopropylthiazol-2-yl)amino]pyrrolidine-2,5-dione (3R)-3-[(4-isopropylthiazol-2-yl…
| 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) | 0.67 | 1.42 | -11.89 | 2 | 5 | 0 | 71 | 239.3 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.86 | -1.12 | -40.81 | 1 | 5 | -1 | 77 | 238.292 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.86 | -1.12 | -40.78 | 1 | 5 | -1 | 77 | 238.292 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.67 | 1.86 | -34.98 | 3 | 5 | 1 | 72 | 240.308 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.67 | 1.86 | -34.91 | 3 | 5 | 1 | 72 | 240.308 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
