In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2009 | 30 | Yes |
Popular Name: 1-[(2R)-2-[[4-(2-fluorobenzoyl)piperazin-1-yl]methyl]morpholin-4-yl]-2-(2-thienyl)ethanone 1-[(2R)-2-[[4-(2-fluorobenzoyl)p…
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) | 1.80 | 7.74 | -20.49 | 0 | 6 | 0 | 53 | 431.533 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.80 | 9.92 | -55.68 | 1 | 6 | 1 | 54 | 432.541 | 5 | ↓ |