| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 30th, 2007 | 31 | No |
Popular Name: 3-hydroxy-1-(3-hydroxypropyl)-4-(4-nitrobenzoyl)-5-(3-nitrophenyl)-5H-pyrrol-2-one 3-hydroxy-1-(3-hydroxypropyl)-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) | 1.91 | 7.21 | -50.74 | 1 | 11 | -1 | 172 | 426.361 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.36 | -1.72 | -34.01 | 2 | 11 | 0 | 169 | 427.369 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.33 | -1.44 | -26.27 | 1 | 11 | 0 | 166 | 427.369 | 8 | ↓ |
