| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 17th, 2006 | 28 | No |
Popular Name: 4-(4-chlorobenzoyl)-1-(3-dimethylaminopropyl)-3-hydroxy-5-(4-pyridyl)-5H-pyrrol-2-one 4-(4-chlorobenzoyl)-1-(3-dimethy…
| 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) | 2.07 | 8.56 | -53.22 | 2 | 6 | 1 | 75 | 400.886 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.48 | 9.25 | -62.15 | 1 | 6 | 1 | 72 | 400.886 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.51 | 8.5 | -118.18 | 3 | 6 | 2 | 76 | 401.894 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.48 | 9.53 | -117.04 | 2 | 6 | 2 | 73 | 401.894 | 7 | ↓ |
