| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 13th, 2008 | 23 | No |
Popular Name: 4-(methoxymethyl)-6-methyl-2-[(2-nitrophenyl)methylsulfanyl]pyridine-3-carbonitrile 4-(methoxymethyl)-6-methyl-2-[(2…
| 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) | 3.17 | 9 | -12.67 | 0 | 6 | 0 | 92 | 329.381 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.17 | 9.23 | -39.24 | 1 | 6 | 1 | 93 | 330.389 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
