In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 16th, 2010 | 26 | Yes |
Popular Name: [4-(5-bromo-2-pyridyl)piperazin-1-yl]-(4-pyrrol-1-ylphenyl)methanone [4-(5-bromo-2-pyridyl)piperazin-…
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) | 2.83 | 11.32 | -11.62 | 0 | 5 | 0 | 41 | 411.303 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.83 | 11.65 | -41.42 | 1 | 5 | 1 | 43 | 412.311 | 3 | ↓ |