| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 3rd, 2012 | 27 | Yes |
Popular Name: (2S)-2-amino-2-phenyl-1-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)-1-piperidyl]ethanone (2S)-2-amino-2-phenyl-1-[4-(6-py…
None
| 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) | -0.06 | 8.35 | -10.75 | 2 | 6 | 0 | 75 | 365.481 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.06 | 9.03 | -39.9 | 3 | 6 | 1 | 77 | 366.489 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.06 | 8.68 | -49.65 | 3 | 6 | 1 | 77 | 366.489 | 4 | ↓ |
| Lo Low (pH 4.5-6) | -0.06 | 9.36 | -95.34 | 4 | 6 | 2 | 78 | 367.497 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.