In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 5th, 2007 | 28 | No |
Popular Name: 1-butyl-5-(3-fluorophenyl)-4-[hydroxy-(4-methoxyphenyl)-methylene]-pyrrolidine-2,3-dione 1-butyl-5-(3-fluorophenyl)-4-[hy…
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) | 4.01 | 8.99 | -62.45 | 0 | 5 | -1 | 70 | 382.411 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.43 | 1.51 | -12.33 | 0 | 5 | 0 | 63 | 383.419 | 7 | ↓ |
Lo Low (pH 4.5-6) | 4.01 | 8.17 | -17.51 | 1 | 5 | 0 | 67 | 383.419 | 7 | ↓ |