| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 6th, 2008 | 31 | No |
Popular Name: (5S)-4-(4-allyloxybenzoyl)-1-(2-diethylaminoethyl)-3-hydroxy-5-(2-thienyl)-5H-pyrrol-2-one (5S)-4-(4-allyloxybenzoyl)-1-(2-…
| 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) | 3.76 | 10.66 | -72.58 | 1 | 6 | 0 | 74 | 440.565 | 11 | ↓ |
| Hi High (pH 8-9.5) | 3.76 | 8.36 | -56.62 | 0 | 6 | -1 | 73 | 439.557 | 11 | ↓ |
| Mid Mid (pH 6-8) | 4.21 | 9.49 | -58.54 | 2 | 6 | 1 | 71 | 441.573 | 10 | ↓ |
| Mid Mid (pH 6-8) | 3.18 | 10.46 | -63.31 | 1 | 6 | 1 | 68 | 441.573 | 11 | ↓ |
