In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 13th, 2008 | 17 | Yes |
Popular Name: (2R,3aS,7aS)-1-thiazol-2-yl-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylic (2R,3aS,7aS)-1-thiazol-2-yl-2,3,…
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 | 5.25 | -52.22 | 0 | 4 | -1 | 56 | 251.331 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.67 | 5.67 | -48.05 | 1 | 4 | 0 | 58 | 252.339 | 2 | ↓ |