In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 21 | Yes |
Popular Name: (5-amino-2-bromo-phenyl)-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methanone (5-amino-2-bromo-phenyl)-[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) | 1.53 | 3.68 | -11.03 | 2 | 4 | 0 | 50 | 366.181 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.53 | 5.78 | -47.02 | 3 | 4 | 1 | 51 | 367.189 | 3 | ↓ |