| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 25th, 2004 | 31 | No |
Popular Name: (5S)-4-(3-ethoxybenzoyl)-1-(3-imidazol-1-ylpropyl)-2-keto-5-(2-thienyl)-3-pyrrolin-3-olate (5S)-4-(3-ethoxybenzoyl)-1-(3-im…
| 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) | 2.64 | 11.21 | -46.23 | 0 | 7 | -1 | 87 | 436.513 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.05 | -0.65 | -26.72 | 0 | 7 | 0 | 81 | 437.521 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.64 | -0.19 | -50.22 | 2 | 7 | 1 | 85 | 438.529 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.05 | -0.37 | -57.55 | 1 | 7 | 1 | 82 | 438.529 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.64 | 11.69 | -56.59 | 1 | 7 | 0 | 89 | 437.521 | 9 | ↓ |
