| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2008 | 27 | No |
Popular Name: (5S)-1-(2-dimethylaminoethyl)-3-hydroxy-4-(2-hydroxybenzoyl)-5-phenyl-5H-pyrrol-2-one (5S)-1-(2-dimethylaminoethyl)-3-…
| 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) | 2.35 | 7.96 | -77.87 | 2 | 6 | 0 | 85 | 366.417 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.35 | 8.99 | -133.21 | 1 | 6 | -1 | 88 | 365.409 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.35 | 6.46 | -133.11 | 0 | 6 | -2 | 87 | 364.401 | 6 | ↓ |
