In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 16 | Yes |
Popular Name: 1-(5-bromo-2-thienyl)-2-(4-methylpiperazin-1-yl)ethanone 1-(5-bromo-2-thienyl)-2-(4-methy…
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) | 2.21 | 5.81 | -36.49 | 1 | 3 | 1 | 25 | 304.233 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.21 | 3.44 | -5.22 | 0 | 3 | 0 | 24 | 303.225 | 3 | ↓ |