In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 23rd, 2010 | 29 | No |
Popular Name: (2S)-3-(4-chlorobenzoyl)-4-hydroxy-1-(2-hydroxyethyl)-2-(1-naphthyl)-2H-pyrrol-5-one (2S)-3-(4-chlorobenzoyl)-4-hydro…
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) | 3.58 | 8.04 | -55.83 | 1 | 5 | -1 | 81 | 406.845 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.58 | 7.28 | -12.85 | 2 | 5 | 0 | 78 | 407.853 | 5 | ↓ |