| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 21st, 2009 | 21 | No |
Popular Name: 2-{[(3,4-dimethylphenyl)imino]methyl}-4-nitro-6-methylphenol 2-{[(3,4-dimethylphenyl)imino]me…
| 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) | 4.34 | 8.09 | -7.56 | 1 | 5 | 0 | 78 | 284.315 | 3 | ↓ |
| Mid Mid (pH 6-8) | 4.34 | 7.63 | -31.71 | 0 | 5 | -1 | 81 | 283.307 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 4.34 | 7.29 | -43.07 | 2 | 5 | 1 | 80 | 285.323 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 4.34 | 8.58 | -39.18 | 2 | 5 | 1 | 80 | 285.323 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.