In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2011 | 19 | Yes |
Popular Name: (1R)-1-(3-bromophenyl)-2-[4-(2-hydroxyethyl)piperazin-1-yl]ethanol (1R)-1-(3-bromophenyl)-2-[4-(2-h…
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) | 1.20 | 1.65 | -34.72 | 3 | 4 | 1 | 48 | 330.246 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.20 | 1.6 | -39.64 | 3 | 4 | 1 | 48 | 330.246 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.20 | -0.69 | -6.04 | 2 | 4 | 0 | 47 | 329.238 | 5 | ↓ |