| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 21st, 2008 | 23 | No |
Popular Name: 2-[(4-hydroxy-3-nitro-phenyl)methyleneamino]-4,5,6,7-tetrahydrobenzothiophene-3-carbonitrile 2-[(4-hydroxy-3-nitro-phenyl)met…
| 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) | 3.78 | 8.69 | -11.58 | 1 | 6 | 0 | 102 | 327.365 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.78 | 9.69 | -44.12 | 0 | 6 | -1 | 105 | 326.357 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.78 | 8.88 | -42.98 | 0 | 6 | -1 | 105 | 326.357 | 3 | ↓ |
