In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 3rd, 2010 | 15 | Yes |
Popular Name: 1-[(1R)-1-(2,4-dimethylthiazol-5-yl)ethyl]pyrrolidin-3-one 1-[(1R)-1-(2,4-dimethylthiazol-5…
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) | 0.71 | 5.79 | -42.96 | 1 | 3 | 1 | 34 | 225.337 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.71 | 3.35 | -7.13 | 0 | 3 | 0 | 33 | 224.329 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.