| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 27th, 2007 | 37 | No |
Popular Name: 3-hydroxy-1-(2-methoxyethyl)-4-[4-(m-tolylmethoxy)benzoyl]-5-(4-nitrophenyl)-5H-pyrrol-2-one 3-hydroxy-1-(2-methoxyethyl)-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) | 4.40 | 12.36 | -55.19 | 0 | 9 | -1 | 125 | 501.515 | 10 | ↓ |
| Mid Mid (pH 6-8) | 4.84 | 11.3 | -30.55 | 1 | 9 | 0 | 122 | 502.523 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.81 | 12.33 | -22.47 | 0 | 9 | 0 | 119 | 502.523 | 10 | ↓ |
