| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 13th, 2010 | 24 | No |
Popular Name: [4-[(5-bromo-2-thienyl)methyl]piperazin-1-yl]-(3-nitrophenyl)methanone [4-[(5-bromo-2-thienyl)methyl]pi…
| 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) | 2.96 | 8.21 | -16.22 | 0 | 6 | 0 | 69 | 410.293 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.96 | 10.42 | -62.76 | 1 | 6 | 1 | 71 | 411.301 | 4 | ↓ |
