In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 11th, 2009 | 19 | Yes |
Popular Name: (4-bromo-1H-pyrrol-2-yl)-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methanone (4-bromo-1H-pyrrol-2-yl)-[4-(2,2…
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) | 2.08 | 4.25 | -12.14 | 1 | 4 | 0 | 39 | 340.143 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.08 | 6.42 | -54.71 | 2 | 4 | 1 | 41 | 341.151 | 3 | ↓ |