In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 17th, 2008 | 27 | Yes |
Popular Name: (3R)-3-methyl-N-[4-methyl-5-(2-pyridyl)thiazol-2-yl]-1-oxo-isochroman-3-carboxamide (3R)-3-methyl-N-[4-methyl-5-(2-p…
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) | 3.05 | 9.65 | -14.04 | 1 | 6 | 0 | 81 | 379.441 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.05 | 9.72 | -38.74 | 2 | 6 | 1 | 82 | 380.449 | 3 | ↓ |