| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 6th, 2007 | 31 | No |
| 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) | 3.46 | 11.12 | -70.94 | 1 | 6 | 0 | 74 | 426.488 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.46 | 8.58 | -56.25 | 0 | 6 | -1 | 73 | 425.48 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.88 | 2 | -47.49 | 1 | 6 | 1 | 68 | 427.496 | 9 | ↓ |
Popular Name: (2R)-3-(4-butoxybenzoyl)-2-(2-fluorophenyl)-4-hydroxy-1,2-dihydropyrrol-5-one (2R)-3-(4-butoxybenzoyl)-2-(2-fl…
| 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) | 3.74 | 7.09 | -54.3 | 1 | 5 | -1 | 78 | 368.384 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 3.74 | 6.33 | -11.48 | 2 | 5 | 0 | 76 | 369.392 | 7 | ↓ |
