In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 28th, 2008 | 32 | Yes |
Popular Name: [2-(4-fluorophenyl)-4-quinolyl]-[4-(2-pyrrolidin-1-ylethyl)piperazin-1-yl]methanone [2-(4-fluorophenyl)-4-quinolyl]-…
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) | 3.52 | 11.18 | -46.68 | 1 | 5 | 1 | 41 | 433.551 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.52 | 8.65 | -10.28 | 0 | 5 | 0 | 40 | 432.543 | 5 | ↓ |