| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 22nd, 2006 | 29 | No |
Popular Name: 1-(2-diethylaminoethyl)-3-hydroxy-4-(4-methylbenzoyl)-5-(4-pyridyl)-5H-pyrrol-2-one 1-(2-diethylaminoethyl)-3-hydrox…
| 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) | 2.32 | 9.03 | -52.82 | 2 | 6 | 1 | 75 | 394.495 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.74 | 9.73 | -62.31 | 1 | 6 | 1 | 72 | 394.495 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 2.32 | 9.31 | -105.14 | 3 | 6 | 2 | 76 | 395.503 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 1.74 | 10.01 | -120.19 | 2 | 6 | 2 | 73 | 395.503 | 8 | ↓ |
