In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 5th, 2009 | 23 | Yes |
Popular Name: N-(1-benzyl-4-piperidyl)-4,5-dichloro-1H-pyrrole-2-carboxamide N-(1-benzyl-4-piperidyl)-4,5-dic…
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) | 3.51 | 8.53 | -51.35 | 3 | 4 | 1 | 49 | 353.273 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.51 | 8.05 | -52.67 | 2 | 4 | 0 | 48 | 352.265 | 4 | ↓ |