In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 23rd, 2010 | 27 | No |
Popular Name: (2S)-3-(4-bromobenzoyl)-1-butyl-4-hydroxy-2-(4-hydroxyphenyl)-2H-pyrrol-5-one (2S)-3-(4-bromobenzoyl)-1-butyl-…
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) | 4.14 | 7.36 | -55.49 | 1 | 5 | -1 | 81 | 429.29 | 6 | ↓ |
Lo Low (pH 4.5-6) | 4.14 | 6.61 | -12.8 | 2 | 5 | 0 | 78 | 430.298 | 6 | ↓ |