| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 22nd, 2006 | 30 | No |
Popular Name: 3-hydroxy-1-(3-methoxypropyl)-4-(4-methylbenzoyl)-5-(3-nitrophenyl)-5H-pyrrol-2-one 3-hydroxy-1-(3-methoxypropyl)-4-…
| 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) | 3.02 | 9.63 | -55.22 | 0 | 8 | -1 | 115 | 409.418 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.43 | 9.61 | -20.81 | 0 | 8 | 0 | 110 | 410.426 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.46 | 8.61 | -27.75 | 1 | 8 | 0 | 113 | 410.426 | 7 | ↓ |
