| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 23rd, 2009 | 26 | No |
Popular Name: (5Z)-2-(4-ethylanilino)-5-[(4-hydroxy-3-nitro-phenyl)methylene]thiazol-4-one (5Z)-2-(4-ethylanilino)-5-[(4-hy…
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| 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) | 5.22 | 7.66 | -14.81 | 2 | 7 | 0 | 111 | 369.402 | 4 | ↓ |
| Hi High (pH 8-9.5) | 5.68 | 6.5 | -90.42 | 0 | 7 | -2 | 117 | 367.386 | 4 | ↓ |
| Hi High (pH 8-9.5) | 5.68 | 7.17 | -90.55 | 0 | 7 | -2 | 117 | 367.386 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.73 | 7.82 | -51.56 | 1 | 7 | -1 | 110 | 368.394 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.73 | 9.37 | -47.96 | 1 | 7 | -1 | 111 | 368.394 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.73 | 8.83 | -95.99 | 0 | 7 | -2 | 113 | 367.386 | 5 | ↓ |
| Mid Mid (pH 6-8) | 5.22 | 8.22 | -40.09 | 1 | 7 | -1 | 114 | 368.394 | 4 | ↓ |
