In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 26th, 2009 | 35 | Yes |
Popular Name: 6-benzamido-2-[4-(3-chlorophenyl)piperazin-1-yl]quinoline-4-carboxylic 6-benzamido-2-[4-(3-chlorophenyl…
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) | 5.30 | 13.59 | -49.79 | 1 | 7 | -1 | 89 | 485.951 | 5 | ↓ |
Mid Mid (pH 6-8) | 5.37 | 11.25 | -54.15 | 1 | 7 | -1 | 92 | 485.951 | 5 | ↓ |
Mid Mid (pH 6-8) | 5.30 | 10.56 | -45.59 | 2 | 7 | 0 | 90 | 486.959 | 5 | ↓ |