| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 5th, 2006 | 29 | No |
Popular Name: 3-hydroxy-1-(3-methoxypropyl)-5-(4-tert-butylphenyl)-4-(2-thienylcarbonyl)-5H-pyrrol-2-one 3-hydroxy-1-(3-methoxypropyl)-5-…
| 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) | 4.24 | 9.81 | -59.69 | 0 | 5 | -1 | 70 | 412.531 | 8 | ↓ |
| Mid Mid (pH 6-8) | 4.68 | -0.5 | -28.36 | 1 | 5 | 0 | 66 | 413.539 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.65 | -0.26 | -19.47 | 0 | 5 | 0 | 63 | 413.539 | 8 | ↓ |
