| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2010 | 20 | No |
Popular Name: N1-[(1S)-1-methyl-2-(1-piperidyl)ethyl]-4-nitro-benzene-1,2-diamine N1-[(1S)-1-methyl-2-(1-piperidyl…
| 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) | 3.10 | 7.12 | -49.64 | 4 | 6 | 1 | 88 | 279.364 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.10 | 4.89 | -7.52 | 3 | 6 | 0 | 87 | 278.356 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
