| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 20th, 2008 | 30 | No |
Popular Name: (5S)-3-hydroxy-4-(3-propoxybenzoyl)-5-(3-pyridyl)-1-thiazol-2-yl-5H-pyrrol-2-one (5S)-3-hydroxy-4-(3-propoxybenzo…
| 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) | 2.80 | 8.25 | -58.6 | 0 | 7 | -1 | 95 | 420.47 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.25 | 7.28 | -26.74 | 1 | 7 | 0 | 93 | 421.478 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.22 | 8.27 | -21.53 | 0 | 7 | 0 | 89 | 421.478 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.80 | 7.88 | -40.07 | 2 | 7 | 1 | 94 | 422.486 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.22 | 8.55 | -48.01 | 1 | 7 | 1 | 91 | 422.486 | 7 | ↓ |
