In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 18th, 2006 | 26 | No |
Popular Name: 3-hydroxy-1-(3-methoxypropyl)-4-[(5-methyl-2-furyl)carbonyl]-5-phenyl-5H-pyrrol-2-one 3-hydroxy-1-(3-methoxypropyl)-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) | 2.11 | 7.41 | -61.2 | 0 | 6 | -1 | 83 | 354.382 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.53 | 7.37 | -18.37 | 0 | 6 | 0 | 77 | 355.39 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.56 | 6.36 | -29.27 | 1 | 6 | 0 | 80 | 355.39 | 6 | ↓ |