In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 21st, 2010 | 33 | No |
Popular Name: (2S)-3-benzoyl-1-[3-(dibutylamino)propyl]-4-hydroxy-2-(4-pyridyl)-2H-pyrrol-5-one (2S)-3-benzoyl-1-[3-(dibutylamin…
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) | 4.26 | 12.72 | -71.86 | 1 | 6 | 0 | 78 | 449.595 | 13 | ↓ |
Lo Low (pH 4.5-6) | 4.26 | 11.98 | -47.58 | 2 | 6 | 1 | 75 | 450.603 | 13 | ↓ |