| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 5th, 2006 | 30 | No |
Popular Name: 4-(4-allyloxybenzoyl)-1-(2-dimethylaminoethyl)-3-hydroxy-5-(4-pyridyl)-5H-pyrrol-2-one 4-(4-allyloxybenzoyl)-1-(2-dimet…
| 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) | 1.82 | 8.23 | -56.03 | 2 | 7 | 1 | 84 | 408.478 | 9 | ↓ |
| Mid Mid (pH 6-8) | 1.24 | 8.93 | -65.34 | 1 | 7 | 1 | 81 | 408.478 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 1.82 | 8.51 | -108.93 | 3 | 7 | 2 | 85 | 409.486 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 1.24 | 9.2 | -123.81 | 2 | 7 | 2 | 82 | 409.486 | 9 | ↓ |
