| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 18th, 2009 | 21 | No |
Popular Name: N-[[3-nitro-4-(4-pyridylmethoxy)phenyl]methyl]ethanamine N-[[3-nitro-4-(4-pyridylmethoxy)…
| 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) | 2.12 | 8.24 | -59.43 | 2 | 6 | 1 | 85 | 288.327 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.12 | 6.87 | -13.79 | 1 | 6 | 0 | 80 | 287.319 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.12 | 8.7 | -94.91 | 3 | 6 | 2 | 86 | 289.335 | 7 | ↓ |
