| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 8th, 2009 | 29 | No |
Popular Name: (5E)-4-(4-methylanilino)-5-[[5-(2-nitrophenyl)-2-furyl]methylene]thiazol-2-one (5E)-4-(4-methylanilino)-5-[[5-(…
| 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) | 5.43 | 10.99 | -20.38 | 1 | 7 | 0 | 104 | 405.435 | 4 | ↓ |
| Mid Mid (pH 6-8) | 5.69 | 11.47 | -57.06 | 0 | 7 | -1 | 103 | 404.427 | 5 | ↓ |
| Mid Mid (pH 6-8) | 5.88 | 9.06 | -67.72 | 0 | 7 | -1 | 107 | 404.427 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 5.69 | 11.24 | -59.72 | 0 | 7 | -1 | 103 | 404.427 | 5 | ↓ |
