In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2008 | 29 | No |
Popular Name: (5S)-4-benzoyl-5-(4-chlorophenyl)-1-(2-diethylaminoethyl)-3-hydroxy-5H-pyrrol-2-one (5S)-4-benzoyl-5-(4-chlorophenyl…
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) | 3.84 | 11.11 | -68.66 | 1 | 5 | 0 | 65 | 412.917 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.84 | 8.78 | -56.95 | 0 | 5 | -1 | 64 | 411.909 | 8 | ↓ |
Lo Low (pH 4.5-6) | 3.84 | 10.28 | -48.74 | 2 | 5 | 1 | 62 | 413.925 | 8 | ↓ |