| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 1st, 2006 | 26 | No |
Popular Name: 3-hydroxy-1-(2-hydroxypropyl)-4-(4-methylbenzoyl)-5-phenyl-1,5-dihydro-2H-pyrrol-2-one 3-hydroxy-1-(2-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) | 2.56 | 7.01 | -45.63 | 1 | 5 | -1 | 81 | 350.394 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.97 | -1.78 | -21.83 | 1 | 5 | 0 | 74 | 351.402 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.00 | 5.17 | -27.17 | 2 | 5 | 0 | 78 | 351.402 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.