In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 21 | Yes |
Popular Name: 4-[(5-bromo-2-thienyl)methyl]-N-(2-ethoxyethyl)piperazine-1-carboxamide 4-[(5-bromo-2-thienyl)methyl]-N-…
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) | 3.03 | 4.6 | -9.36 | 1 | 5 | 0 | 45 | 376.32 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.03 | 6.81 | -48.51 | 2 | 5 | 1 | 46 | 377.328 | 6 | ↓ |