In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 23rd, 2010 | 34 | No |
Popular Name: (2S)-1-butyl-4-hydroxy-3-(4-isopropoxy-3-methyl-benzoyl)-2-(1-naphthyl)-2H-pyrrol-5-one (2S)-1-butyl-4-hydroxy-3-(4-isop…
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) | 6.15 | 13.44 | -60.23 | 0 | 5 | -1 | 70 | 456.562 | 8 | ↓ |
Lo Low (pH 4.5-6) | 6.15 | 12.69 | -12.58 | 1 | 5 | 0 | 67 | 457.57 | 8 | ↓ |