| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 12th, 2010 | 30 | Yes |
Popular Name: (2S)-1-(4-anilinopyrimidin-2-yl)-N-[2-(azepan-1-yl)ethyl]pyrrolidine-2-carboxamide (2S)-1-(4-anilinopyrimidin-2-yl)…
| 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) | 4.03 | 12.92 | -49.07 | 3 | 7 | 1 | 75 | 409.558 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 4.03 | 13.31 | -81.61 | 4 | 7 | 2 | 76 | 410.566 | 7 | ↓ |
