| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 18th, 2009 | 20 | No |
Popular Name: N-methyl-1-[3-nitro-4-(4-pyridylmethoxy)phenyl]methanamine N-methyl-1-[3-nitro-4-(4-pyridyl…
| 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) | 1.75 | 7.38 | -59.97 | 2 | 6 | 1 | 85 | 274.3 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.75 | 5.94 | -13.92 | 1 | 6 | 0 | 80 | 273.292 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.75 | 7.84 | -95.25 | 3 | 6 | 2 | 86 | 275.308 | 6 | ↓ |
