| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 19th, 2011 | 18 | Yes |
Popular Name: (3R)-1-[(2-isopropylthiazol-4-yl)methyl]-3-methyl-pyrrolidine-3-carboxylic (3R)-1-[(2-isopropylthiazol-4-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) | 1.67 | 7.75 | -48.24 | 1 | 4 | 0 | 57 | 268.382 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.67 | 5.29 | -52.77 | 0 | 4 | -1 | 56 | 267.374 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
