In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2009 | 27 | Yes |
Popular Name: N-(4-fluorophenyl)-2-[[4-[(2S)-2-hydroxybutyl]piperazin-1-yl]methyl]oxazole-4-carboxamide N-(4-fluorophenyl)-2-[[4-[(2S)-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) | 1.69 | 1.72 | -46.44 | 3 | 7 | 1 | 83 | 377.44 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.69 | -0.54 | -9.24 | 2 | 7 | 0 | 82 | 376.432 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.69 | 1.71 | -44.25 | 3 | 7 | 1 | 83 | 377.44 | 7 | ↓ |