In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 23rd, 2010 | 27 | No |
Popular Name: (2S)-3-(4-bromobenzoyl)-1-butyl-4-hydroxy-2-(p-tolyl)-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) | 5.07 | 10.89 | -56.28 | 0 | 4 | -1 | 60 | 427.318 | 6 | ↓ |
Lo Low (pH 4.5-6) | 5.07 | 10.13 | -11.27 | 1 | 4 | 0 | 58 | 428.326 | 6 | ↓ |