| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 15th, 2011 | 18 | Yes |
Popular Name: (2S)-1,1,1-trifluoro-3-[(2S)-2-[(2S)-pyrrolidin-2-yl]-1-piperidyl]propan-2-ol (2S)-1,1,1-trifluoro-3-[(2S)-2-[…
| 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) | 1.69 | 3.02 | -35.32 | 3 | 3 | 1 | 37 | 267.315 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.69 | 3.51 | -22.74 | 2 | 3 | 0 | 40 | 266.307 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.69 | 4.04 | -110.04 | 4 | 3 | 2 | 41 | 268.323 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
