In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 23rd, 2010 | 33 | No |
Popular Name: (2S)-2-(3-allyloxyphenyl)-1-butyl-4-hydroxy-3-(4-isopropoxybenzoyl)-2H-pyrrol-5-one (2S)-2-(3-allyloxyphenyl)-1-buty…
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) | 5.29 | 11.3 | -58.33 | 0 | 6 | -1 | 79 | 448.539 | 11 | ↓ |
Lo Low (pH 4.5-6) | 5.29 | 10.53 | -12.69 | 1 | 6 | 0 | 76 | 449.547 | 11 | ↓ |