| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2010 | 17 | No |
Popular Name: (3R)-3-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylamino)pyrrolidine-2,5-dione (3R)-3-(4,5,6,7-tetrahydro-1,3-b…
| 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) | 0.64 | 2.19 | -12.44 | 2 | 5 | 0 | 71 | 251.311 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.82 | -0.36 | -42.09 | 1 | 5 | -1 | 77 | 250.303 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 0.64 | 2.61 | -34 | 3 | 5 | 1 | 72 | 252.319 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
