In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 6th, 2007 | 32 | No |
Popular Name: 1-(6-fluorobenzothiazol-2-yl)-4-[hydroxy-(p-tolyl)methylene]-5-phenyl-pyrrolidine-2,3-dione 1-(6-fluorobenzothiazol-2-yl)-4-…
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) | 5.22 | 12.4 | -60.31 | 0 | 5 | -1 | 73 | 443.479 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.64 | 12.65 | -12.33 | 0 | 5 | 0 | 67 | 444.487 | 4 | ↓ |
Mid Mid (pH 6-8) | 5.22 | 12.36 | -13.11 | 1 | 5 | 0 | 71 | 444.487 | 4 | ↓ |