| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 22nd, 2008 | 26 | No |
Popular Name: (NE)-N-[(2-hydroxy-5-nitro-1H-indol-3-yl)imino]-2-nitro-benzamide (NE)-N-[(2-hydroxy-5-nitro-1H-in…
| 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) | 3.09 | 4.41 | -33.86 | 2 | 11 | 0 | 169 | 355.266 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.09 | 5.22 | -61.16 | 1 | 11 | -1 | 172 | 354.258 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.09 | 3.33 | -48.69 | 1 | 11 | -1 | 168 | 354.258 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.64 | 5 | -48.81 | 1 | 11 | -1 | 169 | 354.258 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.09 | 4.08 | -57.13 | 1 | 11 | -1 | 172 | 354.258 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.09 | 2.18 | -47.44 | 1 | 11 | -1 | 168 | 354.258 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.64 | 4.75 | -56.36 | 1 | 11 | -1 | 169 | 354.258 | 4 | ↓ |
