| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 6th, 2010 | 19 | Yes |
Popular Name: (2S)-3-[4-(3-fluoro-2-pyridyl)-1,4-diazepan-1-yl]-2-methyl-propan-1-amine (2S)-3-[4-(3-fluoro-2-pyridyl)-1…
| 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) | 0.97 | 5.3 | -44.98 | 3 | 4 | 1 | 47 | 267.372 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.97 | 6.76 | -112.05 | 4 | 4 | 2 | 48 | 268.38 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
