| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2010 | 21 | No |
Popular Name: 5-nitro-2-[(2S)-2-(3-pyridyl)pyrrolidin-1-yl]aniline 5-nitro-2-[(2S)-2-(3-pyridyl)pyr…
| 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) | 2.16 | 7.48 | -8.1 | 2 | 6 | 0 | 88 | 284.319 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.16 | 7.95 | -39.86 | 3 | 6 | 1 | 89 | 285.327 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
