| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 6th, 2008 | 32 | No |
Popular Name: (5S)-1-allyl-4-(4-allyloxy-2-methyl-benzoyl)-3-hydroxy-5-(4-nitrophenyl)-5H-pyrrol-2-one (5S)-1-allyl-4-(4-allyloxy-2-met…
| 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) | 4.06 | 11.81 | -53.18 | 0 | 8 | -1 | 115 | 433.44 | 9 | ↓ |
| Mid Mid (pH 6-8) | 4.51 | 10.51 | -31.75 | 1 | 8 | 0 | 113 | 434.448 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.48 | 11.75 | -22.1 | 0 | 8 | 0 | 110 | 434.448 | 9 | ↓ |
