In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 23rd, 2010 | 30 | No |
Popular Name: (2R)-1-butyl-4-hydroxy-3-(7-methoxybenzofuran-2-carbonyl)-2-(4-pyridyl)-2H-pyrrol-5-one (2R)-1-butyl-4-hydroxy-3-(7-meth…
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) | 3.10 | 8.06 | -60.13 | 0 | 7 | -1 | 96 | 405.43 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.10 | 7.77 | -44.76 | 2 | 7 | 1 | 94 | 407.446 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.10 | 7.31 | -13.41 | 1 | 7 | 0 | 93 | 406.438 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.10 | 8.52 | -69.82 | 1 | 7 | 0 | 97 | 406.438 | 7 | ↓ |