In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 23rd, 2010 | 30 | No |
Popular Name: (2S)-1-butyl-4-hydroxy-3-(4-methylbenzoyl)-2-(2-propoxyphenyl)-2H-pyrrol-5-one (2S)-1-butyl-4-hydroxy-3-(4-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) | 5.15 | 11.79 | -64.49 | 0 | 5 | -1 | 70 | 406.502 | 9 | ↓ |
Lo Low (pH 4.5-6) | 5.15 | 11.05 | -13.17 | 1 | 5 | 0 | 67 | 407.51 | 9 | ↓ |