In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 22nd, 2008 | 30 | No |
Popular Name: 2-[4-[(3R)-1-(4-fluorophenyl)-2,5-dioxo-pyrrolidin-3-yl]piperazin-1-yl]-N-phenyl-acetamide 2-[4-[(3R)-1-(4-fluorophenyl)-2,…
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) | 1.59 | 5.42 | -18.02 | 1 | 7 | 0 | 73 | 410.449 | 5 | ↓ |
Ref Reference (pH 7) | 1.59 | 5.7 | -17.39 | 1 | 7 | 0 | 73 | 410.449 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.59 | 7.91 | -56.88 | 2 | 7 | 1 | 74 | 411.457 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.59 | 7.89 | -56.27 | 2 | 7 | 1 | 74 | 411.457 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.59 | 7.61 | -52.94 | 2 | 7 | 1 | 74 | 411.457 | 5 | ↓ |