| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 9th, 2009 | 24 | No |
Popular Name: (5Z)-2-anilino-5-[(4-hydroxy-3-nitro-phenyl)methylene]thiazol-4-one (5Z)-2-anilino-5-[(4-hydroxy-3-n…
| 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) | 4.31 | 5.79 | -15.55 | 2 | 7 | 0 | 111 | 341.348 | 3 | ↓ |
| Ref Reference (pH 7) | 4.31 | 6.24 | -15.14 | 2 | 7 | 0 | 111 | 341.348 | 3 | ↓ |
| Ref Reference (pH 7) | 3.82 | 6.38 | -51.08 | 1 | 7 | -1 | 110 | 340.34 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.77 | 5.08 | -90.04 | 0 | 7 | -2 | 117 | 339.332 | 3 | ↓ |
| Hi High (pH 8-9.5) | 4.77 | 5.75 | -89.74 | 0 | 7 | -2 | 117 | 339.332 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.82 | 7.38 | -95.21 | 0 | 7 | -2 | 113 | 339.332 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.31 | 6.81 | -40.46 | 1 | 7 | -1 | 114 | 340.34 | 3 | ↓ |
| Mid Mid (pH 6-8) | 4.31 | 7.25 | -41.07 | 1 | 7 | -1 | 114 | 340.34 | 3 | ↓ |
